Product OPENEYE NAME: tetrasodium 1-phenyl-3-[4-[4-[(3-phenyl-1,3-disulfonato-propyl)amino]phenyl]sulfonylanilino]propane-1,3-disulfonate
CAS Name: tetrasodium 1-phenyl-3-[4-[4-[(3-phenyl-1,3-disulfonatopropyl)amino]phenyl]sulfonylanilino]propane-1,3-disulfonate
IUPAC NAME: tetrasodium 1-phenyl-3-[4-[4-[(3-phenyl-1,3-disulfonatopropyl)amino]phenyl]sulfonylanilino]propane-1,3-disulfonate
SYSTEMATIC NAME: tetrasodium 1-phenyl-3-[[4-[4-[(3-phenyl-1,3-disulfonato-propyl)amino]phenyl]sulfonylphenyl]amino]propane-1,3-disulfonate
MOLECULAR FORMULA: C30H28N2Na4O14S5
MOLECULAR WEIGHT: 892.8324
SMILES: C1=CC=C(C=C1)C(CC(NC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)NC(CC(C4=CC=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
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Product OPENEYE NAME: 1-phenyl-3-[4-[4-[(3-phenyl-1,3-disulfo-propyl)amino]phenyl]sulfonylanilino]propane-1,3-disulfonic acid
CAS Name: 1-phenyl-3-[4-[4-[(3-phenyl-1,3-disulfopropyl)amino]phenyl]sulfonylanilino]propane-1,3-disulfonic acid
IUPAC NAME: 1-phenyl-3-[4-[4-[(3-phenyl-1,3-disulfopropyl)amino]phenyl]sulfonylanilino]propane-1,3-disulfonic acid
SYSTEMATIC NAME: 1-phenyl-3-[[4-[4-[(3-phenyl-1,3-disulfo-propyl)amino]phenyl]sulfonylphenyl]amino]propane-1,3-disulfonic acid
MOLECULAR FORMULA: C30H32N2O14S5
MOLECULAR WEIGHT: 804.90508
SMILES: C1=CC=C(C=C1)C(CC(NC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)NC(CC(C4=CC=CC=C4)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O
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Product OPENEYE NAME: 2-amino-5-chloro-benzenesulfonic acid
CAS Name: 2-amino-5-chlorobenzenesulfonic acid
IUPAC NAME: 2-amino-5-chlorobenzenesulfonic acid
SYSTEMATIC NAME: 2-azanyl-5-chloranyl-benzenesulfonic acid
MOLECULAR FORMULA: C6H6ClNO3S
MOLECULAR WEIGHT: 207.63474
SMILES: C1=CC(=C(C=C1Cl)S(=O)(=O)O)N
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Product OPENEYE NAME: [[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] hydrogen phosphate
CAS Name: [[(2R,3S,4R,5R)-5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl] hydrogen phosphate
IUPAC NAME: [[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
SYSTEMATIC NAME: [[(2R,3S,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl] hydrogen phosphate
MOLECULAR FORMULA: C15H24N2O17P2
MOLECULAR WEIGHT: 566.301782
SMILES: C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O
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Product OPENEYE NAME: 3-amino-2,5-dichloro-benzoic acid
CAS Name: 3-amino-2,5-dichlorobenzoic acid
IUPAC NAME: 3-amino-2,5-dichlorobenzoic acid
SYSTEMATIC NAME: 3-azanyl-2,5-bis(chloranyl)benzoic acid
MOLECULAR FORMULA: C7H5Cl2NO2
MOLECULAR WEIGHT: 206.0261
SMILES: C1=C(C=C(C(=C1N)Cl)C(=O)O)Cl
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Product OPENEYE NAME: 2-hydroxy-3,5-diiodo-benzoic acid
CAS Name: 2-hydroxy-3,5-diiodobenzoic acid
IUPAC NAME: 2-hydroxy-3,5-diiodobenzoic acid
SYSTEMATIC NAME: 3,5-bis(iodanyl)-2-oxidanyl-benzoic acid
MOLECULAR FORMULA: C7H4I2O3
MOLECULAR WEIGHT: 389.9138
SMILES: C1=C(C=C(C(=C1I)O)C(=O)O)I
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Product OPENEYE NAME: (4-benzoyloxy-2,5-dioxo-3-furyl) benzoate
CAS Name: benzoic acid (4-benzoyloxy-2,5-dioxo-3-furanyl) ester
IUPAC NAME: (4-benzoyloxy-2,5-dioxofuran-3-yl) benzoate
SYSTEMATIC NAME: [2,5-bis(oxidanylidene)-4-(phenylcarbonyloxy)furan-3-yl] benzoate
MOLECULAR FORMULA: C18H10O7
MOLECULAR WEIGHT: 338.2678
SMILES: C1=CC=C(C=C1)C(=O)OC2=C(C(=O)OC2=O)OC(=O)C3=CC=CC=C3
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Product OPENEYE NAME: (2-isopropyl-5-methyl-cyclohexyl) 2-aminobenzoate
CAS Name: 2-aminobenzoic acid (5-methyl-2-propan-2-ylcyclohexyl) ester
IUPAC NAME: (5-methyl-2-propan-2-ylcyclohexyl) 2-aminobenzoate
SYSTEMATIC NAME: (5-methyl-2-propan-2-yl-cyclohexyl) 2-azanylbenzoate
MOLECULAR FORMULA: C17H25NO2
MOLECULAR WEIGHT: 275.3859
SMILES: CC1CCC(C(C1)OC(=O)C2=CC=CC=C2N)C(C)C
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Product OPENEYE NAME: 2-(1,2-dihydroxyethyl)-4,5-dihydroxy-furan-3-one; 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
CAS Name: 2-(1,2-dihydroxyethyl)-4,5-dihydroxy-3-furanone; 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
IUPAC NAME: 2-(1,2-dihydroxyethyl)-4,5-dihydroxyfuran-3-one; 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
SYSTEMATIC NAME: 2-[1,2-bis(oxidanyl)ethyl]-4,5-bis(oxidanyl)furan-3-one; 4-[2-(methylamino)-1-oxidanyl-ethyl]benzene-1,2-diol
MOLECULAR FORMULA: C15H21NO9
MOLECULAR WEIGHT: 359.32854
SMILES: CNCC(C1=CC(=C(C=C1)O)O)O.C(C(C1C(=O)C(=C(O1)O)O)O)O
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Product OPENEYE NAME: methyl 2-aminobenzoate
CAS Name: 2-aminobenzoic acid methyl ester
IUPAC NAME: methyl 2-aminobenzoate
SYSTEMATIC NAME: methyl 2-azanylbenzoate
MOLECULAR FORMULA: C8H9NO2
MOLECULAR WEIGHT: 151.16256
SMILES: COC(=O)C1=CC=CC=C1N
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Product OPENEYE NAME: 2,4-dichloro-1-(dichloromethyl)benzene
CAS Name: 2,4-dichloro-1-(dichloromethyl)benzene
IUPAC NAME: 2,4-dichloro-1-(dichloromethyl)benzene
SYSTEMATIC NAME: 1-[bis(chloranyl)methyl]-2,4-bis(chloranyl)benzene
MOLECULAR FORMULA: C7H4Cl4
MOLECULAR WEIGHT: 229.91866
SMILES: C1=CC(=C(C=C1Cl)Cl)C(Cl)Cl
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Product OPENEYE NAME: 2-methoxyaniline hydrochloride
CAS Name: 2-methoxyaniline hydrochloride
IUPAC NAME: 2-methoxyaniline hydrochloride
SYSTEMATIC NAME: 2-methoxyaniline hydrochloride
MOLECULAR FORMULA: C7H10ClNO
MOLECULAR WEIGHT: 159.6134
SMILES: COC1=CC=CC=C1N.Cl
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Product OPENEYE NAME: quinolin-1-ium-8-ol sulfate
CAS Name: 8-quinolin-1-iumol sulfate
IUPAC NAME: quinolin-1-ium-8-ol sulfate
SYSTEMATIC NAME: quinolin-1-ium-8-ol sulfate
MOLECULAR FORMULA: C18H16N2O6S
MOLECULAR WEIGHT: 388.39444
SMILES: C1=CC2=C(C(=C1)O)[NH+]=CC=C2.C1=CC2=C(C(=C1)O)[NH+]=CC=C2.[O-]S(=O)(=O)[O-]
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Product OPENEYE NAME: naphthalen-1-amine
CAS Name: 1-naphthalenamine
IUPAC NAME: naphthalen-1-amine
SYSTEMATIC NAME: naphthalen-1-amine
MOLECULAR FORMULA: C10H9N
MOLECULAR WEIGHT: 143.18516
SMILES: C1=CC=C2C(=C1)C=CC=C2N
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Product OPENEYE NAME: 1-(3-aminophenyl)pyridin-2-one
CAS Name: 1-(3-aminophenyl)-2-pyridinone
IUPAC NAME: 1-(3-aminophenyl)pyridin-2-one
SYSTEMATIC NAME: 1-(3-aminophenyl)pyridin-2-one
MOLECULAR FORMULA: C11H10N2O
MOLECULAR WEIGHT: 186.2099
SMILES: C1=CC(=O)N(C=C1)C2=CC(=CC=C2)N
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Product OPENEYE NAME: [(2R,3S,5R)-5-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
CAS Name: [(2R,3S,5R)-5-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methyl dihydrogen phosphate
IUPAC NAME: [(2R,3S,5R)-5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate
SYSTEMATIC NAME: [(2R,3S,5R)-5-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate
MOLECULAR FORMULA: C9H12FN2O8P
MOLECULAR WEIGHT: 326.172344
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)F)COP(=O)(O)O)O
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Product OPENEYE NAME: acridin-9-amine hydrochloride
CAS Name: 9-acridinamine hydrochloride
IUPAC NAME: acridin-9-amine hydrochloride
SYSTEMATIC NAME: acridin-9-amine hydrochloride
MOLECULAR FORMULA: C13H11ClN2
MOLECULAR WEIGHT: 230.69284
SMILES: C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)N.Cl
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Product OPENEYE NAME: [3-(diethylamino)-2,2-dimethyl-propyl] 3-hydroxy-2-phenyl-propanoate; phosphoric acid
CAS Name: 3-hydroxy-2-phenylpropanoic acid [3-(diethylamino)-2,2-dimethylpropyl] ester; phosphoric acid
IUPAC NAME: [3-(diethylamino)-2,2-dimethylpropyl] 3-hydroxy-2-phenylpropanoate; phosphoric acid
SYSTEMATIC NAME: [3-(diethylamino)-2,2-dimethyl-propyl] 3-oxidanyl-2-phenyl-propanoate; phosphoric acid
MOLECULAR FORMULA: C18H32NO7P
MOLECULAR WEIGHT: 405.422941
SMILES: CCN(CC)CC(C)(C)COC(=O)C(CO)C1=CC=CC=C1.OP(=O)(O)O
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Product OPENEYE NAME: [3-(diethylamino)-2,2-dimethyl-propyl] 3-hydroxy-2-phenyl-propanoate
CAS Name: 3-hydroxy-2-phenylpropanoic acid [3-(diethylamino)-2,2-dimethylpropyl] ester
IUPAC NAME: [3-(diethylamino)-2,2-dimethylpropyl] 3-hydroxy-2-phenylpropanoate
SYSTEMATIC NAME: [3-(diethylamino)-2,2-dimethyl-propyl] 3-oxidanyl-2-phenyl-propanoate
MOLECULAR FORMULA: C18H29NO3
MOLECULAR WEIGHT: 307.42776
SMILES: CCN(CC)CC(C)(C)COC(=O)C(CO)C1=CC=CC=C1
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Product OPENEYE NAME: 5-amino-2,3-dihydrotriazolo[4,5-d]pyrimidin-7-one
CAS Name: 5-amino-2,3-dihydrotriazolo[4,5-d]pyrimidin-7-one
IUPAC NAME: 5-amino-2,3-dihydrotriazolo[4,5-d]pyrimidin-7-one
SYSTEMATIC NAME: 5-azanyl-2,3-dihydro-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
MOLECULAR FORMULA: C4H4N6O
MOLECULAR WEIGHT: 152.11416
SMILES: C12=NNNC1=NC(=NC2=O)N
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