Product OPENEYE NAME: (2,4-dihydroxy-3-methoxy-phenyl)-(3-methoxyphenyl)methanone
CAS Name: (2,4-dihydroxy-3-methoxyphenyl)-(3-methoxyphenyl)methanone
IUPAC NAME: (2,4-dihydroxy-3-methoxyphenyl)-(3-methoxyphenyl)methanone
SYSTEMATIC NAME: [3-methoxy-2,4-bis(oxidanyl)phenyl]-(3-methoxyphenyl)methanone
MOLECULAR FORMULA: C15H14O5
MOLECULAR WEIGHT: 274.26866
SMILES: COC1=CC=CC(=C1)C(=O)C2=C(C(=C(C=C2)O)OC)O
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Product OPENEYE NAME: 5,5-dimethylbicyclo[2.2.1]hept-2-ene-4-carboxylic acid
CAS Name: 5,5-dimethyl-4-bicyclo[2.2.1]hept-2-enecarboxylic acid
IUPAC NAME: 5,5-dimethylbicyclo[2.2.1]hept-2-ene-4-carboxylic acid
SYSTEMATIC NAME: 5,5-dimethylbicyclo[2.2.1]hept-2-ene-4-carboxylic acid
MOLECULAR FORMULA: C10H14O2
MOLECULAR WEIGHT: 166.21696
SMILES: CC1(CC2CC1(C=C2)C(=O)O)C
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Product OPENEYE NAME: 1-butyl-2,3-dimethyl-4,5-diphenyl-benzene
CAS Name: 1-butyl-2,3-dimethyl-4,5-diphenylbenzene
IUPAC NAME: 1-butyl-2,3-dimethyl-4,5-diphenylbenzene
SYSTEMATIC NAME: 1-butyl-2,3-dimethyl-4,5-diphenyl-benzene
MOLECULAR FORMULA: C24H26
MOLECULAR WEIGHT: 314.46324
SMILES: CCCCC1=C(C(=C(C(=C1)C2=CC=CC=C2)C3=CC=CC=C3)C)C
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Product OPENEYE NAME: 1-(2-aminopropanoyl)pyrrolidine-2-carboxylic acid hydrochloride
CAS Name: 1-(2-amino-1-oxopropyl)-2-pyrrolidinecarboxylic acid hydrochloride
IUPAC NAME: 1-(2-aminopropanoyl)pyrrolidine-2-carboxylic acid hydrochloride
SYSTEMATIC NAME: 1-(2-azanylpropanoyl)pyrrolidine-2-carboxylic acid hydrochloride
MOLECULAR FORMULA: C8H15ClN2O3
MOLECULAR WEIGHT: 222.6693
SMILES: CC(C(=O)N1CCCC1C(=O)O)N.Cl
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Product OPENEYE NAME: benzyl 2-aminopropanoate; pyrrolidine-2-carboxylic acid
CAS Name: 2-aminopropanoic acid (phenylmethyl) ester; 2-pyrrolidinecarboxylic acid
IUPAC NAME: benzyl 2-aminopropanoate; pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: (phenylmethyl) 2-azanylpropanoate; pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C15H22N2O4
MOLECULAR WEIGHT: 294.34618
SMILES: CC(C(=O)OCC1=CC=CC=C1)N.C1CC(NC1)C(=O)O
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Product OPENEYE NAME: 2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoic acid; fumaric acid; pyrrolidine-2-carboxylic acid
CAS Name: (E)-2-butenedioic acid; 2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoic acid; 2-pyrrolidinecarboxylic acid
IUPAC NAME: (E)-but-2-enedioic acid; 2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoic acid; pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoic acid; pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C24H34N2O10
MOLECULAR WEIGHT: 510.53416
SMILES: CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)O.C1CC(NC1)C(=O)O.C(=C/C(=O)O)\C(=O)O
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Product OPENEYE NAME: potassium 1-(2-aminopropanoyl)pyrrolidine-2-carboxylic acid
CAS Name: potassium 1-(2-amino-1-oxopropyl)-2-pyrrolidinecarboxylic acid
IUPAC NAME: potassium 1-(2-aminopropanoyl)pyrrolidine-2-carboxylic acid
SYSTEMATIC NAME: potassium 1-(2-azanylpropanoyl)pyrrolidine-2-carboxylic acid
MOLECULAR FORMULA: C8H14KN2O3+
MOLECULAR WEIGHT: 225.30666
SMILES: CC(C(=O)N1CCCC1C(=O)O)N.[K+]
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Product OPENEYE NAME: 2-[[2-[tert-butoxycarbonyl-[2-[[4-carboxy-2-(2,6-diaminohexanoylamino)-5,5-dimethyl-hexanoyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-4-tert-butyl-pentanedioic acid
CAS Name: 2-tert-butyl-4-[[2-[[2-[[4-carboxy-2-[(2,6-diamino-1-oxohexyl)amino]-5,5-dimethyl-1-oxohexyl]amino]-3-methyl-1-oxobutyl]-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]pentanedioic acid
IUPAC NAME: 2-tert-butyl-4-[[2-[[2-[[4-carboxy-2-(2,6-diaminohexanoylamino)-5,5-dimethylhexanoyl]amino]-3-methylbutanoyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-methylbutanoyl]amino]pentanedioic acid
SYSTEMATIC NAME: 2-[[2-[[2-[[2-[2,6-bis(azanyl)hexanoylamino]-4-carboxy-5,5-dimethyl-hexanoyl]amino]-3-methyl-butanoyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-methyl-butanoyl]amino]-4-tert-butyl-pentanedioic acid
MOLECULAR FORMULA: C39H70N6O12
MOLECULAR WEIGHT: 815.0061
SMILES: CC(C)C(C(=O)N(C(C(C)C)C(=O)NC(CC(C(=O)O)C(C)(C)C)C(=O)O)C(=O)OC(C)(C)C)NC(=O)C(CC(C(=O)O)C(C)(C)C)NC(=O)C(CCCCN)N
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Product OPENEYE NAME: 2-[[2-[[2-[[4-carboxy-2-[[2-(2,6-diaminohexanoylamino)-3-hydroxy-propanoyl]amino]butanoyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]pentanedioic acid
CAS Name: 2-[[2-[[2-[[4-carboxy-2-[[2-[(2,6-diamino-1-oxohexyl)amino]-3-hydroxy-1-oxopropyl]amino]-1-oxobutyl]amino]-3-methyl-1-oxobutyl]amino]-3-methyl-1-oxobutyl]amino]pentanedioic acid
IUPAC NAME: 2-[[2-[[2-[[4-carboxy-2-[[2-(2,6-diaminohexanoylamino)-3-hydroxypropanoyl]amino]butanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]pentanedioic acid
SYSTEMATIC NAME: 2-[[2-[[2-[[2-[[2-[2,6-bis(azanyl)hexanoylamino]-3-oxidanyl-propanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]pentanedioic acid
MOLECULAR FORMULA: C29H51N7O12
MOLECULAR WEIGHT: 689.75494
SMILES: CC(C)C(C(=O)NC(C(C)C)C(=O)NC(CCC(=O)O)C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CO)NC(=O)C(CCCCN)N
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Product OPENEYE NAME: 2-[[2-[[2-[(2-amino-4-carboxy-5,5-dimethyl-hexanoyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-4-tert-butyl-pentanedioic acid
CAS Name: 2-[[2-[[2-[(2-amino-4-carboxy-5,5-dimethyl-1-oxohexyl)amino]-3-methyl-1-oxobutyl]amino]-3-methyl-1-oxobutyl]amino]-4-tert-butylpentanedioic acid
IUPAC NAME: 2-[[2-[[2-[(2-amino-4-carboxy-5,5-dimethylhexanoyl)amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-4-tert-butylpentanedioic acid
SYSTEMATIC NAME: 2-[[2-[[2-[(2-azanyl-4-carboxy-5,5-dimethyl-hexanoyl)amino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-4-tert-butyl-pentanedioic acid
MOLECULAR FORMULA: C28H50N4O9
MOLECULAR WEIGHT: 586.718
SMILES: CC(C)C(C(=O)NC(C(C)C)C(=O)NC(CC(C(=O)O)C(C)(C)C)C(=O)O)NC(=O)C(CC(C(=O)O)C(C)(C)C)N
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Product OPENEYE NAME: 3-tert-butoxy-2-[tert-butoxycarbonyl(2,6-diaminohexanoyl)amino]propanoic acid
CAS Name: 2-[(2,6-diamino-1-oxohexyl)-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid
IUPAC NAME: 2-[2,6-diaminohexanoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid
SYSTEMATIC NAME: 2-[2,6-bis(azanyl)hexanoyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid
MOLECULAR FORMULA: C18H35N3O6
MOLECULAR WEIGHT: 389.487
SMILES: CC(C)(C)OCC(C(=O)O)N(C(=O)C(CCCCN)N)C(=O)OC(C)(C)C
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Product OPENEYE NAME: 2-[[2-[tert-butoxycarbonyl-[2-[[2-[[3-tert-butoxy-2-(2,6-diaminohexanoylamino)propanoyl]amino]-4-carboxy-5,5-dimethyl-hexanoyl]amino]-3-methyl-butanoyl]amino]-3-methyl-butanoyl]amino]-4-tert-butyl-pentanedioic acid
CAS Name: 2-tert-butyl-4-[[2-[[2-[[4-carboxy-2-[[2-[(2,6-diamino-1-oxohexyl)amino]-3-[(2-methylpropan-2-yl)oxy]-1-oxopropyl]amino]-5,5-dimethyl-1-oxohexyl]amino]-3-methyl-1-oxobutyl]-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]pentanedioic
IUPAC NAME: 2-tert-butyl-4-[[2-[[2-[[4-carboxy-2-[[2-(2,6-diaminohexanoylamino)-3-[(2-methylpropan-2-yl)oxy]propanoyl]amino]-5,5-dimethylhexanoyl]amino]-3-methylbutanoyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-methylbutanoyl]amino]pentanedioic acid
SYSTEMATIC NAME: 2-[[2-[[2-[[2-[[2-[2,6-bis(azanyl)hexanoylamino]-3-[(2-methylpropan-2-yl)oxy]propanoyl]amino]-4-carboxy-5,5-dimethyl-hexanoyl]amino]-3-methyl-butanoyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-methyl-butanoyl]amino]-4-tert-butyl-pentanedioic acid
MOLECULAR FORMULA: C46H83N7O14
MOLECULAR WEIGHT: 958.18972
SMILES: CC(C)C(C(=O)N(C(C(C)C)C(=O)NC(CC(C(=O)O)C(C)(C)C)C(=O)O)C(=O)OC(C)(C)C)NC(=O)C(CC(C(=O)O)C(C)(C)C)NC(=O)C(COC(C)(C)C)NC(=O)C(CCCCN)N
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Product OPENEYE NAME: [1-methyl-2-(4-pyridyl)ethyl] formate
CAS Name: formic acid 1-pyridin-4-ylpropan-2-yl ester
IUPAC NAME: 1-pyridin-4-ylpropan-2-yl formate
SYSTEMATIC NAME: 1-pyridin-4-ylpropan-2-yl methanoate
MOLECULAR FORMULA: C9H11NO2
MOLECULAR WEIGHT: 165.18914
SMILES: CC(CC1=CC=NC=C1)OC=O
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Product OPENEYE NAME: (4Z)-4-(thiazol-2-ylhydrazono)naphthalen-1-one
CAS Name: (4Z)-4-(2-thiazolylhydrazinylidene)-1-naphthalenone
IUPAC NAME: (4Z)-4-(1,3-thiazol-2-ylhydrazinylidene)naphthalen-1-one
SYSTEMATIC NAME: (4Z)-4-(1,3-thiazol-2-ylhydrazinylidene)naphthalen-1-one
MOLECULAR FORMULA: C13H9N3OS
MOLECULAR WEIGHT: 255.29506
SMILES: C1=CC=C2C(=O)C=C/C(=N/NC3=NC=CS3)/C2=C1
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