Product OPENEYE NAME: tert-butyl 3,3-ditert-butoxypropanoate
CAS Name: 3,3-bis[(2-methylpropan-2-yl)oxy]propanoic acid tert-butyl ester
IUPAC NAME: tert-butyl 3,3-bis[(2-methylpropan-2-yl)oxy]propanoate
SYSTEMATIC NAME: tert-butyl 3,3-bis[(2-methylpropan-2-yl)oxy]propanoate
MOLECULAR FORMULA: C15H30O4
MOLECULAR WEIGHT: 274.3963
SMILES: CC(C)(C)OC(CC(=O)OC(C)(C)C)OC(C)(C)C
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Product OPENEYE NAME: 2-ethylhexyl 5-ethyl-3-(2-ethylhexyl)nonanoate
CAS Name: 5-ethyl-3-(2-ethylhexyl)nonanoic acid 2-ethylhexyl ester
IUPAC NAME: 2-ethylhexyl 5-ethyl-3-(2-ethylhexyl)nonanoate
SYSTEMATIC NAME: 2-ethylhexyl 5-ethyl-3-(2-ethylhexyl)nonanoate
MOLECULAR FORMULA: C27H54O2
MOLECULAR WEIGHT: 410.71646
SMILES: CCCCC(CC)CC(CC(CC)CCCC)CC(=O)OCC(CC)CCCC
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Product OPENEYE NAME: hexyl 3-hexylnonanoate
CAS Name: 3-hexylnonanoic acid hexyl ester
IUPAC NAME: hexyl 3-hexylnonanoate
SYSTEMATIC NAME: hexyl 3-hexylnonanoate
MOLECULAR FORMULA: C21H42O2
MOLECULAR WEIGHT: 326.55698
SMILES: CCCCCCC(CCCCCC)CC(=O)OCCCCCC
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Product OPENEYE NAME: isopentyl 3-isopentyl-6-methyl-heptanoate
CAS Name: 6-methyl-3-(3-methylbutyl)heptanoic acid 3-methylbutyl ester
IUPAC NAME: 3-methylbutyl 6-methyl-3-(3-methylbutyl)heptanoate
SYSTEMATIC NAME: 3-methylbutyl 6-methyl-3-(3-methylbutyl)heptanoate
MOLECULAR FORMULA: C18H36O2
MOLECULAR WEIGHT: 284.47724
SMILES: CC(C)CCC(CCC(C)C)CC(=O)OCCC(C)C
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Product OPENEYE NAME: propyl 3,3-dipropoxypropanoate
CAS Name: 3,3-dipropoxypropanoic acid propyl ester
IUPAC NAME: propyl 3,3-dipropoxypropanoate
SYSTEMATIC NAME: propyl 3,3-dipropoxypropanoate
MOLECULAR FORMULA: C12H24O4
MOLECULAR WEIGHT: 232.31656
SMILES: CCCOC(CC(=O)OCCC)OCCC
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Product OPENEYE NAME: isopropyl 3,3-diisopropoxypropanoate
CAS Name: 3,3-di(propan-2-yloxy)propanoic acid propan-2-yl ester
IUPAC NAME: propan-2-yl 3,3-di(propan-2-yloxy)propanoate
SYSTEMATIC NAME: propan-2-yl 3,3-di(propan-2-yloxy)propanoate
MOLECULAR FORMULA: C12H24O4
MOLECULAR WEIGHT: 232.31656
SMILES: CC(C)OC(CC(=O)OC(C)C)OC(C)C
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Product OPENEYE NAME: isohexyl 3-isohexyl-7-methyl-octanoate
CAS Name: 7-methyl-3-(4-methylpentyl)octanoic acid 4-methylpentyl ester
IUPAC NAME: 4-methylpentyl 7-methyl-3-(4-methylpentyl)octanoate
SYSTEMATIC NAME: 4-methylpentyl 7-methyl-3-(4-methylpentyl)octanoate
MOLECULAR FORMULA: C21H42O2
MOLECULAR WEIGHT: 326.55698
SMILES: CC(C)CCCC(CCCC(C)C)CC(=O)OCCCC(C)C
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Product OPENEYE NAME: pentyl 3-pentyloctanoate
CAS Name: 3-pentyloctanoic acid pentyl ester
IUPAC NAME: pentyl 3-pentyloctanoate
SYSTEMATIC NAME: pentyl 3-pentyloctanoate
MOLECULAR FORMULA: C18H36O2
MOLECULAR WEIGHT: 284.47724
SMILES: CCCCCC(CCCCC)CC(=O)OCCCCC
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Product OPENEYE NAME: 5-methylhexyl 8-methyl-3-(5-methylhexyl)nonanoate
CAS Name: 8-methyl-3-(5-methylhexyl)nonanoic acid 5-methylhexyl ester
IUPAC NAME: 5-methylhexyl 8-methyl-3-(5-methylhexyl)nonanoate
SYSTEMATIC NAME: 5-methylhexyl 8-methyl-3-(5-methylhexyl)nonanoate
MOLECULAR FORMULA: C24H48O2
MOLECULAR WEIGHT: 368.63672
SMILES: CC(C)CCCCC(CCCCC(C)C)CC(=O)OCCCCC(C)C
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Product OPENEYE NAME: heptyl 3-heptyldecanoate
CAS Name: 3-heptyldecanoic acid heptyl ester
IUPAC NAME: heptyl 3-heptyldecanoate
SYSTEMATIC NAME: heptyl 3-heptyldecanoate
MOLECULAR FORMULA: C24H48O2
MOLECULAR WEIGHT: 368.63672
SMILES: CCCCCCCC(CCCCCCC)CC(=O)OCCCCCCC
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Product OPENEYE NAME: sec-butyl 3,3-disec-butoxypropanoate
CAS Name: 3,3-di(butan-2-yloxy)propanoic acid butan-2-yl ester
IUPAC NAME: butan-2-yl 3,3-di(butan-2-yloxy)propanoate
SYSTEMATIC NAME: butan-2-yl 3,3-di(butan-2-yloxy)propanoate
MOLECULAR FORMULA: C15H30O4
MOLECULAR WEIGHT: 274.3963
SMILES: CCC(C)OC(CC(=O)OC(C)CC)OC(C)CC
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Product OPENEYE NAME: 1-(2-nitrophenyl)imidazole-4,5-dicarboxylic acid
CAS Name: 1-(2-nitrophenyl)imidazole-4,5-dicarboxylic acid
IUPAC NAME: 1-(2-nitrophenyl)imidazole-4,5-dicarboxylic acid
SYSTEMATIC NAME: 1-(2-nitrophenyl)imidazole-4,5-dicarboxylic acid
MOLECULAR FORMULA: C11H7N3O6
MOLECULAR WEIGHT: 277.18978
SMILES: C1=CC=C(C(=C1)N2C=NC(=C2C(=O)O)C(=O)O)[N+](=O)[O-]
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Product OPENEYE NAME: 4-thioxo-5H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 4-sulfanylidene-5H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
IUPAC NAME: 4-sulfanylidene-5H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 4-sulfanylidene-5H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C11H7N3O2S
MOLECULAR WEIGHT: 245.25718
SMILES: C1=CC=C2C(=C1)NC(=S)C3=C(N=CN23)C(=O)O
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Product OPENEYE NAME: 4-chloroimidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 4-chloro-3-imidazo[1,5-a]quinoxalinecarboxylic acid
IUPAC NAME: 4-chloroimidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 4-chloranylimidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C11H6ClN3O2
MOLECULAR WEIGHT: 247.63724
SMILES: C1=CC=C2C(=C1)N=C(C3=C(N=CN23)C(=O)O)Cl
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Product OPENEYE NAME: 5-methyl-2H-imidazo[1,5-a]quinoxaline-1,4-dione
CAS Name: 5-methyl-2H-imidazo[1,5-a]quinoxaline-1,4-dione
IUPAC NAME: 5-methyl-2H-imidazo[1,5-a]quinoxaline-1,4-dione
SYSTEMATIC NAME: 5-methyl-2H-imidazo[1,5-a]quinoxaline-1,4-dione
MOLECULAR FORMULA: C11H9N3O2
MOLECULAR WEIGHT: 215.20806
SMILES: CN1C2=CC=CC=C2N3C(=CNC3=O)C1=O
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Product OPENEYE NAME: 5-methyl-1-methylsulfanyl-4-oxo-7-(trifluoromethyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 5-methyl-1-(methylthio)-4-oxo-7-(trifluoromethyl)-3-imidazo[1,5-a]quinoxalinecarboxylic acid
IUPAC NAME: 5-methyl-1-methylsulfanyl-4-oxo-7-(trifluoromethyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 5-methyl-1-methylsulfanyl-4-oxidanylidene-7-(trifluoromethyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C14H10F3N3O3S
MOLECULAR WEIGHT: 357.30771
SMILES: CN1C2=C(C=CC(=C2)C(F)(F)F)N3C(=C(N=C3SC)C(=O)O)C1=O
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Product OPENEYE NAME: 4-chloro-7-(trifluoromethyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 4-chloro-7-(trifluoromethyl)-3-imidazo[1,5-a]quinoxalinecarboxylic acid
IUPAC NAME: 4-chloro-7-(trifluoromethyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 4-chloranyl-7-(trifluoromethyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C12H5ClF3N3O2
MOLECULAR WEIGHT: 315.63521
SMILES: C1=CC2=C(C=C1C(F)(F)F)N=C(C3=C(N=CN23)C(=O)O)Cl
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Product OPENEYE NAME: 1-bromo-5-methyl-4-oxo-7-(trifluoromethyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 1-bromo-5-methyl-4-oxo-7-(trifluoromethyl)-3-imidazo[1,5-a]quinoxalinecarboxylic acid
IUPAC NAME: 1-bromo-5-methyl-4-oxo-7-(trifluoromethyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 1-bromanyl-5-methyl-4-oxidanylidene-7-(trifluoromethyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C13H7BrF3N3O3
MOLECULAR WEIGHT: 390.11219
SMILES: CN1C2=C(C=CC(=C2)C(F)(F)F)N3C(=C(N=C3Br)C(=O)O)C1=O
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Product OPENEYE NAME: 1-bromo-5-methyl-4-oxo-imidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 1-bromo-5-methyl-4-oxo-3-imidazo[1,5-a]quinoxalinecarboxylic acid
IUPAC NAME: 1-bromo-5-methyl-4-oxoimidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 1-bromanyl-5-methyl-4-oxidanylidene-imidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C12H8BrN3O3
MOLECULAR WEIGHT: 322.11422
SMILES: CN1C2=CC=CC=C2N3C(=C(N=C3Br)C(=O)O)C1=O
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Product OPENEYE NAME: 5-methyl-1,4-dioxo-7-(trifluoromethyl)-2H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 5-methyl-1,4-dioxo-7-(trifluoromethyl)-2H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
IUPAC NAME: 5-methyl-1,4-dioxo-7-(trifluoromethyl)-2H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 5-methyl-1,4-bis(oxidanylidene)-7-(trifluoromethyl)-2H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C13H8F3N3O4
MOLECULAR WEIGHT: 327.21553
SMILES: CN1C2=C(C=CC(=C2)C(F)(F)F)N3C(=C(NC3=O)C(=O)O)C1=O
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Product OPENEYE NAME: 1,4-dichloroimidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 1,4-dichloro-3-imidazo[1,5-a]quinoxalinecarboxylic acid
IUPAC NAME: 1,4-dichloroimidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 1,4-bis(chloranyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C11H5Cl2N3O2
MOLECULAR WEIGHT: 282.0823
SMILES: C1=CC=C2C(=C1)N=C(C3=C(N=C(N23)Cl)C(=O)O)Cl
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Product OPENEYE NAME: 4-(2-ethoxycarbonylhydrazino)imidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 4-(ethoxycarbonylhydrazo)-3-imidazo[1,5-a]quinoxalinecarboxylic acid
IUPAC NAME: 4-(2-ethoxycarbonylhydrazinyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 4-(2-ethoxycarbonylhydrazinyl)imidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C14H13N5O4
MOLECULAR WEIGHT: 315.28412
SMILES: CCOC(=O)NNC1=NC2=CC=CC=C2N3C1=C(N=C3)C(=O)O
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Product OPENEYE NAME: 5-methyl-4-oxo-1-thioxo-7-(trifluoromethyl)-2H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 5-methyl-4-oxo-1-sulfanylidene-7-(trifluoromethyl)-2H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
IUPAC NAME: 5-methyl-4-oxo-1-sulfanylidene-7-(trifluoromethyl)-2H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 5-methyl-4-oxidanylidene-1-sulfanylidene-7-(trifluoromethyl)-2H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C13H8F3N3O3S
MOLECULAR WEIGHT: 343.28113
SMILES: CN1C2=C(C=CC(=C2)C(F)(F)F)N3C(=C(NC3=S)C(=O)O)C1=O
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Product OPENEYE NAME: 7-methylsulfonyl-4-oxo-5H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
CAS Name: 7-methylsulfonyl-4-oxo-5H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
IUPAC NAME: 7-methylsulfonyl-4-oxo-5H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
SYSTEMATIC NAME: 7-methylsulfonyl-4-oxidanylidene-5H-imidazo[1,5-a]quinoxaline-3-carboxylic acid
MOLECULAR FORMULA: C12H9N3O5S
MOLECULAR WEIGHT: 307.28196
SMILES: CS(=O)(=O)C1=CC2=C(C=C1)N3C=NC(=C3C(=O)N2)C(=O)O
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