Product OPENEYE NAME: 7-chloro-4-hydroxy-N-(nitrosomethyl)-5-phenyl-3H-1,4-benzodiazepin-2-imine
CAS Name: 7-chloro-4-hydroxy-N-(nitrosomethyl)-5-phenyl-3H-1,4-benzodiazepin-2-imine
IUPAC NAME: 7-chloro-4-hydroxy-N-(nitrosomethyl)-5-phenyl-3H-1,4-benzodiazepin-2-imine
SYSTEMATIC NAME: 7-chloranyl-N-(nitrosomethyl)-4-oxidanyl-5-phenyl-3H-1,4-benzodiazepin-2-imine
MOLECULAR FORMULA: C16H13ClN4O2
MOLECULAR WEIGHT: 328.75302
SMILES: C1/C(=N/CN=O)/N=C2C=CC(=CC2=C(N1O)C3=CC=CC=C3)Cl
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Product OPENEYE NAME: 2-[8-chloro-6-(2-chlorophenyl)-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]acetic acid
CAS Name: 2-[8-chloro-6-(2-chlorophenyl)-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]acetic acid
IUPAC NAME: 2-[8-chloro-6-(2-chlorophenyl)-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]acetic acid
SYSTEMATIC NAME: 2-[8-chloranyl-6-(2-chlorophenyl)-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-3-yl]ethanoic acid
MOLECULAR FORMULA: C20H15Cl2N3O2
MOLECULAR WEIGHT: 400.258
SMILES: CC1=NC(=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4Cl)CC(=O)O
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Product OPENEYE NAME: 3-ethyl-1-methyl-5-phenyl-4,6,8,8a-tetrahydro-3aH-pyrazolo[3,4-e][1,4]diazepin-7-one
CAS Name: 3-ethyl-1-methyl-5-phenyl-4,6,8,8a-tetrahydro-3aH-pyrazolo[3,4-e][1,4]diazepin-7-one
IUPAC NAME: 3-ethyl-1-methyl-5-phenyl-4,6,8,8a-tetrahydro-3aH-pyrazolo[3,4-e][1,4]diazepin-7-one
SYSTEMATIC NAME: 3-ethyl-1-methyl-5-phenyl-4,6,8,8a-tetrahydro-3aH-pyrazolo[3,4-e][1,4]diazepin-7-one
MOLECULAR FORMULA: C15H20N4O
MOLECULAR WEIGHT: 272.3455
SMILES: CCC1=NN(C2C1CN(CC(=O)N2)C3=CC=CC=C3)C
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Product OPENEYE NAME: 4-[3,7-di(butanoyl)-3,7-dihydroxy-10,13-dimethyl-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
CAS Name: 4-[3,7-dihydroxy-10,13-dimethyl-3,7-bis(1-oxobutyl)-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
IUPAC NAME: 4-[3,7-di(butanoyl)-3,7-dihydroxy-10,13-dimethyl-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
SYSTEMATIC NAME: 4-[3,7-di(butanoyl)-10,13-dimethyl-3,7-bis(oxidanyl)-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
MOLECULAR FORMULA: C32H52O6
MOLECULAR WEIGHT: 532.75168
SMILES: CCCC(=O)C1(CCC2(C3CCC4(C(C3C(CC2C1)(C(=O)CCC)O)CCC4C(C)CCC(=O)O)C)C)O
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Product OPENEYE NAME: 4-(7-butanoyl-3,7-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid
CAS Name: 4-[3,7-dihydroxy-10,13-dimethyl-7-(1-oxobutyl)-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
IUPAC NAME: 4-(7-butanoyl-3,7-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid
SYSTEMATIC NAME: 4-[7-butanoyl-10,13-dimethyl-3,7-bis(oxidanyl)-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
MOLECULAR FORMULA: C28H46O5
MOLECULAR WEIGHT: 462.66184
SMILES: CCCC(=O)C1(CC2CC(CCC2(C3C1C4CCC(C4(CC3)C)C(C)CCC(=O)O)C)O)O
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Product OPENEYE NAME: 4-[3,7-dihydroxy-10,13-dimethyl-7-[(E)-octadec-9-enyl]-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
CAS Name: 4-[3,7-dihydroxy-10,13-dimethyl-7-[(E)-octadec-9-enyl]-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
IUPAC NAME: 4-[3,7-dihydroxy-10,13-dimethyl-7-[(E)-octadec-9-enyl]-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
SYSTEMATIC NAME: 4-[10,13-dimethyl-7-[(E)-octadec-9-enyl]-3,7-bis(oxidanyl)-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
MOLECULAR FORMULA: C42H74O4
MOLECULAR WEIGHT: 643.03456
SMILES: CCCCCCCC/C=C/CCCCCCCCC1(CC2CC(CCC2(C3C1C4CCC(C4(CC3)C)C(C)CCC(=O)O)C)O)O
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Product OPENEYE NAME: 4-[3,7-dihydroxy-10,13-dimethyl-3,7-bis[(E)-octadec-9-enyl]-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
CAS Name: 4-[3,7-dihydroxy-10,13-dimethyl-3,7-bis[(E)-octadec-9-enyl]-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
IUPAC NAME: 4-[3,7-dihydroxy-10,13-dimethyl-3,7-bis[(E)-octadec-9-enyl]-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
SYSTEMATIC NAME: 4-[10,13-dimethyl-3,7-bis[(E)-octadec-9-enyl]-3,7-bis(oxidanyl)-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
MOLECULAR FORMULA: C60H108O4
MOLECULAR WEIGHT: 893.49712
SMILES: CCCCCCCC/C=C/CCCCCCCCC1(CCC2(C3CCC4(C(C3C(CC2C1)(CCCCCCCC/C=C/CCCCCCCC)O)CCC4C(C)CCC(=O)O)C)C)O
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Product OPENEYE NAME: [17-(2-iodoacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate
CAS Name: propanoic acid [17-(2-iodo-1-oxoethyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] ester
IUPAC NAME: [17-(2-iodoacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate
SYSTEMATIC NAME: [17-(2-iodanylethanoyl)-10,13-dimethyl-3-oxidanylidene-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate
MOLECULAR FORMULA: C24H33IO4
MOLECULAR WEIGHT: 512.42089
SMILES: CCC(=O)OC1(CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(=O)CI
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Product OPENEYE NAME: [17-(2,2-diiodoacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate
CAS Name: propanoic acid [17-(2,2-diiodo-1-oxoethyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] ester
IUPAC NAME: [17-(2,2-diiodoacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate
SYSTEMATIC NAME: [17-[2,2-bis(iodanyl)ethanoyl]-10,13-dimethyl-3-oxidanylidene-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate
MOLECULAR FORMULA: C24H32I2O4
MOLECULAR WEIGHT: 638.31742
SMILES: CCC(=O)OC1(CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(=O)C(I)I
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Product OPENEYE NAME: [17-(2-bromoacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate
CAS Name: propanoic acid [17-(2-bromo-1-oxoethyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] ester
IUPAC NAME: [17-(2-bromoacetyl)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate
SYSTEMATIC NAME: [17-(2-bromanylethanoyl)-10,13-dimethyl-3-oxidanylidene-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] propanoate
MOLECULAR FORMULA: C24H33BrO4
MOLECULAR WEIGHT: 465.42042
SMILES: CCC(=O)OC1(CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(=O)CBr
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Product OPENEYE NAME: [17-(2-bromoacetyl)-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] acetate
CAS Name: acetic acid [17-(2-bromo-1-oxoethyl)-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] ester
IUPAC NAME: [17-(2-bromoacetyl)-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] acetate
SYSTEMATIC NAME: [17-(2-bromanylethanoyl)-10,13-dimethyl-3-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl] ethanoate
MOLECULAR FORMULA: C23H29BrO4
MOLECULAR WEIGHT: 449.37796
SMILES: CC(=O)OC1(CCC2C1(CCC3C2CCC4=CC(=O)C=CC34C)C)C(=O)CBr
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Product OPENEYE NAME: N-iodoacetamide; 1-iodopyrrolidine-2,5-dione
CAS Name: N-iodoacetamide; 1-iodopyrrolidine-2,5-dione
IUPAC NAME: N-iodoacetamide; 1-iodopyrrolidine-2,5-dione
SYSTEMATIC NAME: N-iodanylethanamide; 1-iodanylpyrrolidine-2,5-dione
MOLECULAR FORMULA: C6H8I2N2O3
MOLECULAR WEIGHT: 409.94826
SMILES: CC(=O)NI.C1CC(=O)N(C1=O)I
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