Product OPENEYE NAME: [3-(2,5-dimethoxyphenyl)-3-hydroxy-1-methyl-3-phenyl-propyl]-trimethyl-ammonium iodide
CAS Name: [4-(2,5-dimethoxyphenyl)-4-hydroxy-4-phenylbutan-2-yl]-trimethylammonium iodide
IUPAC NAME: [4-(2,5-dimethoxyphenyl)-4-hydroxy-4-phenylbutan-2-yl]-trimethylazanium iodide
SYSTEMATIC NAME: [4-(2,5-dimethoxyphenyl)-4-oxidanyl-4-phenyl-butan-2-yl]-trimethyl-azanium iodide
MOLECULAR FORMULA: C21H30INO3
MOLECULAR WEIGHT: 471.37227
SMILES: CC(CC(C1=CC=CC=C1)(C2=C(C=CC(=C2)OC)OC)O)[N+](C)(C)C.[I-]
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Product OPENEYE NAME: [3-(2,5-dimethoxyphenyl)-3-hydroxy-1-methyl-3-phenyl-propyl]-trimethyl-ammonium
CAS Name: [4-(2,5-dimethoxyphenyl)-4-hydroxy-4-phenylbutan-2-yl]-trimethylammonium
IUPAC NAME: [4-(2,5-dimethoxyphenyl)-4-hydroxy-4-phenylbutan-2-yl]-trimethylazanium
SYSTEMATIC NAME: [4-(2,5-dimethoxyphenyl)-4-oxidanyl-4-phenyl-butan-2-yl]-trimethyl-azanium
MOLECULAR FORMULA: C21H30NO3+
MOLECULAR WEIGHT: 344.4678
SMILES: CC(CC(C1=CC=CC=C1)(C2=C(C=CC(=C2)OC)OC)O)[N+](C)(C)C
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Product OPENEYE NAME: 7-chloro-1-[3-(dimethylamino)propyl]-5-phenyl-3H-1,4-benzodiazepin-2-one
CAS Name: 7-chloro-1-[3-(dimethylamino)propyl]-5-phenyl-3H-1,4-benzodiazepin-2-one
IUPAC NAME: 7-chloro-1-[3-(dimethylamino)propyl]-5-phenyl-3H-1,4-benzodiazepin-2-one
SYSTEMATIC NAME: 7-chloranyl-1-[3-(dimethylamino)propyl]-5-phenyl-3H-1,4-benzodiazepin-2-one
MOLECULAR FORMULA: C20H22ClN3O
MOLECULAR WEIGHT: 355.86118
SMILES: CN(C)CCCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3
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Product OPENEYE NAME: 1-benzyl-4-(1-benzylpyridin-1-ium-4-yl)pyridin-1-ium dichloride
CAS Name: 1-(phenylmethyl)-4-[1-(phenylmethyl)-4-pyridin-1-iumyl]pyridin-1-ium dichloride
IUPAC NAME: 1-benzyl-4-(1-benzylpyridin-1-ium-4-yl)pyridin-1-ium dichloride
SYSTEMATIC NAME: 1-(phenylmethyl)-4-[1-(phenylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium dichloride
MOLECULAR FORMULA: C24H22Cl2N2
MOLECULAR WEIGHT: 409.35088
SMILES: C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CC4=CC=CC=C4.[Cl-].[Cl-]
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Product OPENEYE NAME: 1-benzyl-4-(1-benzylpyridin-1-ium-4-yl)pyridin-1-ium
CAS Name: 1-(phenylmethyl)-4-[1-(phenylmethyl)-4-pyridin-1-iumyl]pyridin-1-ium
IUPAC NAME: 1-benzyl-4-(1-benzylpyridin-1-ium-4-yl)pyridin-1-ium
SYSTEMATIC NAME: 1-(phenylmethyl)-4-[1-(phenylmethyl)pyridin-1-ium-4-yl]pyridin-1-ium
MOLECULAR FORMULA: C24H22N2+2
MOLECULAR WEIGHT: 338.44488
SMILES: C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C3=CC=[N+](C=C3)CC4=CC=CC=C4
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Product OPENEYE NAME: 3-[(5R,10S,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
CAS Name: 3-[(5R,10S,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
IUPAC NAME: 3-[(5R,10S,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
SYSTEMATIC NAME: 3-[(5R,10S,13R,14S,17R)-10,13-dimethyl-14-oxidanyl-3-oxidanylidene-2,4,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
MOLECULAR FORMULA: C23H32O4
MOLECULAR WEIGHT: 372.49778
SMILES: C[C@]12CCC(=O)C[C@H]1CCC3C2CC[C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C
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MOLECULAR FORMULA: C17H20N4O6
MOLECULAR WEIGHT: 376.3639
SMILES: CC1=C(C(=O)C2=C(C1=O)N3CC4C([C@@]3([C@@H]2COC(=O)N)OC)N4C(=O)C)N
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Product OPENEYE NAME: [2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxo-ethyl] 2,2-dimethylpropanoate
CAS Name: 2,2-dimethylpropanoic acid [2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] ester
IUPAC NAME: [2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] 2,2-dimethylpropanoate
SYSTEMATIC NAME: [2-[10,13-dimethyl-11,17-bis(oxidanyl)-3-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethyl] 2,2-dimethylpropanoate
MOLECULAR FORMULA: C26H36O6
MOLECULAR WEIGHT: 444.56044
SMILES: CC12CC(C3C(C1CCC2(C(=O)COC(=O)C(C)(C)C)O)CCC4=CC(=O)C=CC34C)O
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MOLECULAR FORMULA: C26H34O7
MOLECULAR WEIGHT: 458.54396
SMILES: CC(=O)O[C@@H]1[C@@H]([C@]2(CCC3C([C@@]24[C@@H]1O4)CC[C@]5([C@@]3(CC[C@@H](C5)O)C)O)C)C6=COC(=O)C=C6
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Product OPENEYE NAME: 7-chloro-5-(2-fluorophenyl)-1-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-3H-1,4-benzodiazepin-2-one
CAS Name: 7-chloro-5-(2-fluorophenyl)-1-[3-[4-(2-hydroxyethyl)-1-piperazinyl]propyl]-3H-1,4-benzodiazepin-2-one
IUPAC NAME: 7-chloro-5-(2-fluorophenyl)-1-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-3H-1,4-benzodiazepin-2-one
SYSTEMATIC NAME: 7-chloranyl-5-(2-fluorophenyl)-1-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-3H-1,4-benzodiazepin-2-one
MOLECULAR FORMULA: C24H28ClFN4O2
MOLECULAR WEIGHT: 458.956123
SMILES: C1CN(CCN1CCCN2C(=O)CN=C(C3=C2C=CC(=C3)Cl)C4=CC=CC=C4F)CCO
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Product OPENEYE NAME: ammonium carbamate hydrate
CAS Name: ammonium carbamate hydrate
IUPAC NAME: azanium carbamate hydrate
SYSTEMATIC NAME: azanium carbamate hydrate
MOLECULAR FORMULA: CH8N2O3
MOLECULAR WEIGHT: 96.08582
SMILES: C(=O)(N)[O-].[NH4+].O
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Product OPENEYE NAME: 2-dimethoxyphosphinothioylsulfanylacetic acid
CAS Name: 2-(dimethoxyphosphinothioylthio)acetic acid
IUPAC NAME: 2-dimethoxyphosphinothioylsulfanylacetic acid
SYSTEMATIC NAME: 2-dimethoxyphosphinothioylsulfanylethanoic acid
MOLECULAR FORMULA: C4H9O4PS2
MOLECULAR WEIGHT: 216.215621
SMILES: COP(=S)(OC)SCC(=O)O
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Product OPENEYE NAME: 2-dimethoxyphosphorylsulfanyl-N-methyl-acetamide
CAS Name: 2-(dimethoxyphosphorylthio)-N-methylacetamide
IUPAC NAME: 2-dimethoxyphosphorylsulfanyl-N-methylacetamide
SYSTEMATIC NAME: 2-dimethoxyphosphorylsulfanyl-N-methyl-ethanamide
MOLECULAR FORMULA: C5H12NO4PS
MOLECULAR WEIGHT: 213.191841
SMILES: CNC(=O)CSP(=O)(OC)OC
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Product OPENEYE NAME: 1-cyano-2-(1,1-dimethylpropyl)guanidine
CAS Name: 1-cyano-2-(2-methylbutan-2-yl)guanidine
IUPAC NAME: 1-cyano-2-(2-methylbutan-2-yl)guanidine
SYSTEMATIC NAME: 1-cyano-2-(2-methylbutan-2-yl)guanidine
MOLECULAR FORMULA: C7H14N4
MOLECULAR WEIGHT: 154.21286
SMILES: CCC(C)(C)N=C(N)NC#N
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Product OPENEYE NAME: 1-(2-propylsulfonylvinylsulfonyl)propane
CAS Name: 1-(2-propylsulfonylethenylsulfonyl)propane
IUPAC NAME: 1-(2-propylsulfonylethenylsulfonyl)propane
SYSTEMATIC NAME: 1-(2-propylsulfonylethenylsulfonyl)propane
MOLECULAR FORMULA: C8H16O4S2
MOLECULAR WEIGHT: 240.34024
SMILES: CCCS(=O)(=O)C=CS(=O)(=O)CCC
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Product OPENEYE NAME: diammonium oxalate
CAS Name: diammonium oxalate
IUPAC NAME: diazanium oxalate
SYSTEMATIC NAME: diazanium ethanedioate
MOLECULAR FORMULA: C2H8N2O4
MOLECULAR WEIGHT: 124.09592
SMILES: C(=O)(C(=O)[O-])[O-].[NH4+].[NH4+]
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