Product OPENEYE NAME: 3,5-diamino-4-hydroxy-naphthalene-2,7-disulfonic acid
CAS Name: 3,5-diamino-4-hydroxynaphthalene-2,7-disulfonic acid
IUPAC NAME: 3,5-diamino-4-hydroxynaphthalene-2,7-disulfonic acid
SYSTEMATIC NAME: 3,5-bis(azanyl)-4-oxidanyl-naphthalene-2,7-disulfonic acid
MOLECULAR FORMULA: C10H10N2O7S2
MOLECULAR WEIGHT: 334.3256
SMILES: C1=C2C=C(C(=C(C2=C(C=C1S(=O)(=O)O)N)O)N)S(=O)(=O)O
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Product OPENEYE NAME: [17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
CAS Name: 2-[4-[bis(2-chloroethyl)amino]phenyl]acetic acid [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] ester
IUPAC NAME: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-[4-[bis(2-chloroethyl)amino]phenyl]acetate
SYSTEMATIC NAME: [10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-[4-[bis(2-chloroethyl)amino]phenyl]ethanoate
MOLECULAR FORMULA: C39H59Cl2NO2
MOLECULAR WEIGHT: 644.79726
SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)CC5=CC=C(C=C5)N(CCCl)CCCl)C)C
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Product OPENEYE NAME: N-[4-(4-acetamido-2-methyl-phenyl)-3-methyl-phenyl]acetamide
CAS Name: N-[4-(4-acetamido-2-methylphenyl)-3-methylphenyl]acetamide
IUPAC NAME: N-[4-(4-acetamido-2-methylphenyl)-3-methylphenyl]acetamide
SYSTEMATIC NAME: N-[4-(4-acetamido-2-methyl-phenyl)-3-methyl-phenyl]ethanamide
MOLECULAR FORMULA: C18H20N2O2
MOLECULAR WEIGHT: 296.3636
SMILES: CC1=C(C=CC(=C1)NC(=O)C)C2=C(C=C(C=C2)NC(=O)C)C
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Product OPENEYE NAME: N-[4-(4-amino-3-methyl-phenyl)-2-methyl-phenyl]acetamide
CAS Name: N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide
IUPAC NAME: N-[4-(4-amino-3-methylphenyl)-2-methylphenyl]acetamide
SYSTEMATIC NAME: N-[4-(4-azanyl-3-methyl-phenyl)-2-methyl-phenyl]ethanamide
MOLECULAR FORMULA: C16H18N2O
MOLECULAR WEIGHT: 254.32692
SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=O)C)C)N
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Product OPENEYE NAME: 1-chloro-4-[1-(4-chlorophenyl)ethyl]benzene
CAS Name: 1-chloro-4-[1-(4-chlorophenyl)ethyl]benzene
IUPAC NAME: 1-chloro-4-[1-(4-chlorophenyl)ethyl]benzene
SYSTEMATIC NAME: 1-chloranyl-4-[1-(4-chlorophenyl)ethyl]benzene
MOLECULAR FORMULA: C14H12Cl2
MOLECULAR WEIGHT: 251.15108
SMILES: CC(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 4-(4-chlorophenoxy)butanoic acid
CAS Name: 4-(4-chlorophenoxy)butanoic acid
IUPAC NAME: 4-(4-chlorophenoxy)butanoic acid
SYSTEMATIC NAME: 4-(4-chloranylphenoxy)butanoic acid
MOLECULAR FORMULA: C10H11ClO3
MOLECULAR WEIGHT: 214.64554
SMILES: C1=CC(=CC=C1OCCCC(=O)O)Cl
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Product OPENEYE NAME: 2-octylsulfanylethanol
CAS Name: 2-(octylthio)ethanol
IUPAC NAME: 2-octylsulfanylethanol
SYSTEMATIC NAME: 2-octylsulfanylethanol
MOLECULAR FORMULA: C10H22OS
MOLECULAR WEIGHT: 190.34608
SMILES: CCCCCCCCSCCO
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Product OPENEYE NAME: 6-chloro-2-methoxy-acridin-9-amine
CAS Name: 6-chloro-2-methoxy-9-acridinamine
IUPAC NAME: 6-chloro-2-methoxyacridin-9-amine
SYSTEMATIC NAME: 6-chloranyl-2-methoxy-acridin-9-amine
MOLECULAR FORMULA: C14H11ClN2O
MOLECULAR WEIGHT: 258.70294
SMILES: COC1=CC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)N
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Product OPENEYE NAME: 4-methylacridin-9-amine
CAS Name: 4-methyl-9-acridinamine
IUPAC NAME: 4-methylacridin-9-amine
SYSTEMATIC NAME: 4-methylacridin-9-amine
MOLECULAR FORMULA: C14H12N2
MOLECULAR WEIGHT: 208.25848
SMILES: CC1=CC=CC2=C(C3=CC=CC=C3N=C12)N
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Product OPENEYE NAME: ethyl 11-cyclopent-2-en-1-ylundecanoate
CAS Name: 11-(1-cyclopent-2-enyl)undecanoic acid ethyl ester
IUPAC NAME: ethyl 11-cyclopent-2-en-1-ylundecanoate
SYSTEMATIC NAME: ethyl 11-cyclopent-2-en-1-ylundecanoate
MOLECULAR FORMULA: C18H32O2
MOLECULAR WEIGHT: 280.44548
SMILES: CCOC(=O)CCCCCCCCCCC1CCC=C1
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Product OPENEYE NAME: ethyl N,N-diethylcarbamate
CAS Name: N,N-diethylcarbamic acid ethyl ester
IUPAC NAME: ethyl N,N-diethylcarbamate
SYSTEMATIC NAME: ethyl N,N-diethylcarbamate
MOLECULAR FORMULA: C7H15NO2
MOLECULAR WEIGHT: 145.1995
SMILES: CCN(CC)C(=O)OCC
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Product OPENEYE NAME: 1-allyloxy-2,3,4,5,6-pentabromo-benzene
CAS Name: 1,2,3,4,5-pentabromo-6-prop-2-enoxybenzene
IUPAC NAME: 1,2,3,4,5-pentabromo-6-prop-2-enoxybenzene
SYSTEMATIC NAME: 1,2,3,4,5-pentakis(bromanyl)-6-prop-2-enoxy-benzene
MOLECULAR FORMULA: C9H5Br5O
MOLECULAR WEIGHT: 528.6554
SMILES: C=CCOC1=C(C(=C(C(=C1Br)Br)Br)Br)Br
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Product OPENEYE NAME: 2-nitro-4-sec-butyl-phenol
CAS Name: 4-butan-2-yl-2-nitrophenol
IUPAC NAME: 4-butan-2-yl-2-nitrophenol
SYSTEMATIC NAME: 4-butan-2-yl-2-nitro-phenol
MOLECULAR FORMULA: C10H13NO3
MOLECULAR WEIGHT: 195.21512
SMILES: CCC(C)C1=CC(=C(C=C1)O)[N+](=O)[O-]
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Product OPENEYE NAME: tetrakis(trimethylsilyl) silicate
CAS Name: tetrakis(trimethylsilyl) silicate
IUPAC NAME: tetrakis(trimethylsilyl) silicate
SYSTEMATIC NAME: tetrakis(trimethylsilyl) silicate
MOLECULAR FORMULA: C12H36O4Si5
MOLECULAR WEIGHT: 384.83934
SMILES: C[Si](C)(C)O[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
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Product OPENEYE NAME: 1-methyl-3-(piperidin-1-ium-4-ylmethyl)indole chloride
CAS Name: 1-methyl-3-(4-piperidin-1-iumylmethyl)indole chloride
IUPAC NAME: 1-methyl-3-(piperidin-1-ium-4-ylmethyl)indole chloride
SYSTEMATIC NAME: 1-methyl-3-(piperidin-1-ium-4-ylmethyl)indole chloride
MOLECULAR FORMULA: C15H21ClN2
MOLECULAR WEIGHT: 264.79364
SMILES: CN1C=C(C2=CC=CC=C21)CC3CC[NH2+]CC3.[Cl-]
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Product OPENEYE NAME: 1-methyl-3-(4-piperidylmethyl)indole
CAS Name: 1-methyl-3-(4-piperidinylmethyl)indole
IUPAC NAME: 1-methyl-3-(piperidin-4-ylmethyl)indole
SYSTEMATIC NAME: 1-methyl-3-(piperidin-4-ylmethyl)indole
MOLECULAR FORMULA: C15H20N2
MOLECULAR WEIGHT: 228.3327
SMILES: CN1C=C(C2=CC=CC=C21)CC3CCNCC3
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Product OPENEYE NAME: 2-methoxyethylbenzene
CAS Name: 2-methoxyethylbenzene
IUPAC NAME: 2-methoxyethylbenzene
SYSTEMATIC NAME: 2-methoxyethylbenzene
MOLECULAR FORMULA: C9H12O
MOLECULAR WEIGHT: 136.19098
SMILES: COCCC1=CC=CC=C1
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Product OPENEYE NAME: (8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
CAS Name: (8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
IUPAC NAME: (8R,9S,10R,13S,14S,17R)-17-acetyl-17-hydroxy-6,10,13-trimethyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
SYSTEMATIC NAME: (8R,9S,10R,13S,14S,17R)-17-ethanoyl-6,10,13-trimethyl-17-oxidanyl-2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
MOLECULAR FORMULA: C22H30O3
MOLECULAR WEIGHT: 342.4718
SMILES: CC1=C[C@@H]2[C@H](CC[C@]3([C@H]2CC[C@@]3(C(=O)C)O)C)[C@@]4(C1=CC(=O)CC4)C
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Product OPENEYE NAME: 1-(2-propylsulfonylethylsulfonyl)propane
CAS Name: 1-(2-propylsulfonylethylsulfonyl)propane
IUPAC NAME: 1-(2-propylsulfonylethylsulfonyl)propane
SYSTEMATIC NAME: 1-(2-propylsulfonylethylsulfonyl)propane
MOLECULAR FORMULA: C8H18O4S2
MOLECULAR WEIGHT: 242.35612
SMILES: CCCS(=O)(=O)CCS(=O)(=O)CCC
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Product OPENEYE NAME: 1,2-bis(2-chloroethylsulfanyl)ethane
CAS Name: 1,2-bis(2-chloroethylthio)ethane
IUPAC NAME: 1,2-bis(2-chloroethylsulfanyl)ethane
SYSTEMATIC NAME: 1,2-bis(2-chloroethylsulfanyl)ethane
MOLECULAR FORMULA: C6H12Cl2S2
MOLECULAR WEIGHT: 219.19548
SMILES: C(CSCCCl)SCCCl
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Product OPENEYE NAME: 1-chloro-4-[1,2,2,2-tetrachloro-1-(4-chlorophenyl)ethyl]benzene
CAS Name: 1-chloro-4-[1,2,2,2-tetrachloro-1-(4-chlorophenyl)ethyl]benzene
IUPAC NAME: 1-chloro-4-[1,2,2,2-tetrachloro-1-(4-chlorophenyl)ethyl]benzene
SYSTEMATIC NAME: 1-chloranyl-4-[1,2,2,2-tetrakis(chloranyl)-1-(4-chlorophenyl)ethyl]benzene
MOLECULAR FORMULA: C14H8Cl6
MOLECULAR WEIGHT: 388.93132
SMILES: C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)(C(Cl)(Cl)Cl)Cl)Cl
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Product OPENEYE NAME: 2-methyl-4-(2,2,2-trichloro-1-hydroxy-ethoxy)pentan-2-ol
CAS Name: 2-methyl-4-(2,2,2-trichloro-1-hydroxyethoxy)-2-pentanol
IUPAC NAME: 2-methyl-4-(2,2,2-trichloro-1-hydroxyethoxy)pentan-2-ol
SYSTEMATIC NAME: 2-methyl-4-[2,2,2-tris(chloranyl)-1-oxidanyl-ethoxy]pentan-2-ol
MOLECULAR FORMULA: C8H15Cl3O3
MOLECULAR WEIGHT: 265.5619
SMILES: CC(CC(C)(C)O)OC(C(Cl)(Cl)Cl)O
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Product OPENEYE NAME: 5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
CAS Name: 5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
IUPAC NAME: 5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
SYSTEMATIC NAME: 5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide
MOLECULAR FORMULA: C15H14N2O
MOLECULAR WEIGHT: 238.28446
SMILES: C1CC2=CC=CC=C2N(C3=CC=CC=C31)C(=O)N
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Product OPENEYE NAME: (1R,2R,5R)-2-(1-hydroxy-1-methyl-ethyl)-5-methyl-cyclohexanol
CAS Name: (1R,2R,5R)-2-(2-hydroxypropan-2-yl)-5-methyl-1-cyclohexanol
IUPAC NAME: (1R,2R,5R)-2-(2-hydroxypropan-2-yl)-5-methylcyclohexan-1-ol
SYSTEMATIC NAME: (1R,2R,5R)-5-methyl-2-(2-oxidanylpropan-2-yl)cyclohexan-1-ol
MOLECULAR FORMULA: C10H20O2
MOLECULAR WEIGHT: 172.2646
SMILES: C[C@@H]1CC[C@H]([C@@H](C1)O)C(C)(C)O
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