Product OPENEYE NAME: 5-(1,3-benzodioxol-5-ylmethyl)-7-methyl-[1,3]dioxolo[4,5-g]isoquinoline
CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-7-methyl-[1,3]dioxolo[4,5-g]isoquinoline
IUPAC NAME: 5-(1,3-benzodioxol-5-ylmethyl)-7-methyl-[1,3]dioxolo[4,5-g]isoquinoline
SYSTEMATIC NAME: 5-(1,3-benzodioxol-5-ylmethyl)-7-methyl-[1,3]dioxolo[4,5-g]isoquinoline
MOLECULAR FORMULA: C19H15NO4
MOLECULAR WEIGHT: 321.3267
SMILES: CC1=CC2=CC3=C(C=C2C(=N1)CC4=CC5=C(C=C4)OCO5)OCO3
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Product OPENEYE NAME: 7-hydroxy-10-oxido-phenoxazin-10-ium-3-one
CAS Name: 7-hydroxy-10-oxido-3-phenoxazin-10-iumone
IUPAC NAME: 7-hydroxy-10-oxidophenoxazin-10-ium-3-one
SYSTEMATIC NAME: 10-oxidanidyl-7-oxidanyl-phenoxazin-10-ium-3-one
MOLECULAR FORMULA: C12H7NO4
MOLECULAR WEIGHT: 229.18828
SMILES: C1=CC2=C(C=C1O)OC3=CC(=O)C=CC3=[N+]2[O-]
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Product OPENEYE NAME: 2-(diethylamino)ethyl 4-amino-2-propoxy-benzoate hydrochloride
CAS Name: 4-amino-2-propoxybenzoic acid 2-(diethylamino)ethyl ester hydrochloride
IUPAC NAME: 2-(diethylamino)ethyl 4-amino-2-propoxybenzoate hydrochloride
SYSTEMATIC NAME: 2-(diethylamino)ethyl 4-azanyl-2-propoxy-benzoate hydrochloride
MOLECULAR FORMULA: C16H27ClN2O3
MOLECULAR WEIGHT: 330.85018
SMILES: CCCOC1=C(C=CC(=C1)N)C(=O)OCCN(CC)CC.Cl
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Product OPENEYE NAME: 2-(1-naphthylmethyl)-4,5-dihydro-1H-imidazole hydrochloride
CAS Name: 2-(1-naphthalenylmethyl)-4,5-dihydro-1H-imidazole hydrochloride
IUPAC NAME: 2-(naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole hydrochloride
SYSTEMATIC NAME: 2-(naphthalen-1-ylmethyl)-4,5-dihydro-1H-imidazole hydrochloride
MOLECULAR FORMULA: C14H15ClN2
MOLECULAR WEIGHT: 246.7353
SMILES: C1CN=C(N1)CC2=CC=CC3=CC=CC=C32.Cl
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Product OPENEYE NAME: 1-isothiocyanatonaphthalene
CAS Name: 1-isothiocyanatonaphthalene
IUPAC NAME: 1-isothiocyanatonaphthalene
SYSTEMATIC NAME: 1-isothiocyanatonaphthalene
MOLECULAR FORMULA: C11H7NS
MOLECULAR WEIGHT: 185.24498
SMILES: C1=CC=C2C(=C1)C=CC=C2N=C=S
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Product OPENEYE NAME: 7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid
CAS Name: 7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3S)-3-hydroxyoct-1-enyl]cyclopentyl]-5-heptenoic acid
IUPAC NAME: 7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3S)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid
SYSTEMATIC NAME: 7-[(1R,2R,3R,5S)-3,5-bis(oxidanyl)-2-[(3S)-3-oxidanyloct-1-enyl]cyclopentyl]hept-5-enoic acid
MOLECULAR FORMULA: C20H34O5
MOLECULAR WEIGHT: 354.48096
SMILES: CCCCC[C@@H](C=C[C@H]1[C@@H](C[C@@H]([C@@H]1CC=CCCCC(=O)O)O)O)O
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Product OPENEYE NAME: (2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS Name: (2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
IUPAC NAME: (2S,5R,6R)-6-amino-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
SYSTEMATIC NAME: (2S,5R,6R)-6-azanyl-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
MOLECULAR FORMULA: C8H12N2O3S
MOLECULAR WEIGHT: 216.25748
SMILES: CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)N)C(=O)O)C
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Product OPENEYE NAME: 2-allyl-4-hydroxy-3-methyl-cyclopent-2-en-1-one
CAS Name: 4-hydroxy-3-methyl-2-prop-2-enyl-1-cyclopent-2-enone
IUPAC NAME: 4-hydroxy-3-methyl-2-prop-2-enylcyclopent-2-en-1-one
SYSTEMATIC NAME: 3-methyl-4-oxidanyl-2-prop-2-enyl-cyclopent-2-en-1-one
MOLECULAR FORMULA: C9H12O2
MOLECULAR WEIGHT: 152.19038
SMILES: CC1=C(C(=O)CC1O)CC=C
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Product OPENEYE NAME: 1,2,3,4-tetrafluorobenzene
CAS Name: 1,2,3,4-tetrafluorobenzene
IUPAC NAME: 1,2,3,4-tetrafluorobenzene
SYSTEMATIC NAME: 1,2,3,4-tetrakis(fluoranyl)benzene
MOLECULAR FORMULA: C6H2F4
MOLECULAR WEIGHT: 150.073693
SMILES: C1=CC(=C(C(=C1F)F)F)F
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Product OPENEYE NAME: 2,4,6-trichloro-3-methyl-phenol
CAS Name: 2,4,6-trichloro-3-methylphenol
IUPAC NAME: 2,4,6-trichloro-3-methylphenol
SYSTEMATIC NAME: 2,4,6-tris(chloranyl)-3-methyl-phenol
MOLECULAR FORMULA: C7H5Cl3O
MOLECULAR WEIGHT: 211.473
SMILES: CC1=C(C(=C(C=C1Cl)Cl)O)Cl
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Product OPENEYE NAME: 1-(2-aminophenyl)ethanone
CAS Name: 1-(2-aminophenyl)ethanone
IUPAC NAME: 1-(2-aminophenyl)ethanone
SYSTEMATIC NAME: 1-(2-aminophenyl)ethanone
MOLECULAR FORMULA: C8H9NO
MOLECULAR WEIGHT: 135.16316
SMILES: CC(=O)C1=CC=CC=C1N
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Product OPENEYE NAME: 2-nitrobenzoic acid
CAS Name: 2-nitrobenzoic acid
IUPAC NAME: 2-nitrobenzoic acid
SYSTEMATIC NAME: 2-nitrobenzoic acid
MOLECULAR FORMULA: C7H5NO4
MOLECULAR WEIGHT: 167.1189
SMILES: C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]
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Product OPENEYE NAME: [4-(4-iodooxy-5-isopropyl-2-methyl-phenyl)-2-isopropyl-5-methyl-phenyl] hypoiodite
CAS Name: hypoiodous acid [4-(4-iodooxy-2-methyl-5-propan-2-ylphenyl)-5-methyl-2-propan-2-ylphenyl] ester
IUPAC NAME: [4-(4-iodooxy-2-methyl-5-propan-2-ylphenyl)-5-methyl-2-propan-2-ylphenyl] hypoiodite
SYSTEMATIC NAME: [4-(4-iodanyloxy-2-methyl-5-propan-2-yl-phenyl)-5-methyl-2-propan-2-yl-phenyl] hypoiodite
MOLECULAR FORMULA: C20H24I2O2
MOLECULAR WEIGHT: 550.2123
SMILES: CC1=CC(=C(C=C1C2=CC(=C(C=C2C)OI)C(C)C)C(C)C)OI
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Product OPENEYE NAME: 1,3-dioxoisobenzofuran-5-carboxylic acid
CAS Name: 1,3-dioxo-5-isobenzofurancarboxylic acid
IUPAC NAME: 1,3-dioxo-2-benzofuran-5-carboxylic acid
SYSTEMATIC NAME: 1,3-bis(oxidanylidene)-2-benzofuran-5-carboxylic acid
MOLECULAR FORMULA: C9H4O5
MOLECULAR WEIGHT: 192.12506
SMILES: C1=CC2=C(C=C1C(=O)O)C(=O)OC2=O
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Product OPENEYE NAME: N-(2-nitrophenyl)acetamide
CAS Name: N-(2-nitrophenyl)acetamide
IUPAC NAME: N-(2-nitrophenyl)acetamide
SYSTEMATIC NAME: N-(2-nitrophenyl)ethanamide
MOLECULAR FORMULA: C8H8N2O3
MOLECULAR WEIGHT: 180.16072
SMILES: CC(=O)NC1=CC=CC=C1[N+](=O)[O-]
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