CAS RN: 35249-62-8
CAS Name: 3-(2-bromo-4,5-dimethoxyphenyl)propanenitrile
OPENEYE Name: 3-(2-bromo-4,5-dimethoxy-phenyl)propanenitrile
IUPAC Name: 3-(2-bromo-4,5-dimethoxyphenyl)propanenitrile
SYSTEMATIC NAME: 3-(2-bromanyl-4,5-dimethoxy-phenyl)propanenitrile
MOLECULAR FORMULA: C11H12BrNO2
MOLECULAR WEIGHT: 270.12248
SMILES: COC1=C(C=C(C(=C1)CCC#N)Br)OC
Structure:
CAS RN: 20268-93-3
CAS Name: [3,4-dihydroxy-5-[6-(3-methylbut-2-enylamino)-9-purinyl]-2-oxolanyl]methyl dihydrogen phosphate
OPENEYE Name: [3,4-dihydroxy-5-[6-(3-methylbut-2-enylamino)purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate
IUPAC Name: [3,4-dihydroxy-5-[6-(3-methylbut-2-enylamino)purin-9-yl]oxolan-2-yl]methyl dihydrogen phosphate
SYSTEMATIC NAME: [5-[6-(3-methylbut-2-enylamino)purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate
MOLECULAR FORMULA: C15H22N5O7P
MOLECULAR WEIGHT: 415.338241
SMILES: CC(=CCNC1=NC=NC2=C1N=CN2C3C(C(C(O3)COP(=O)(O)O)O)O)C
Structure:
CAS RN: 41232-34-2
CAS Name: 9,10-dimethyl-1,8-bis(phenylthio)anthracene-9,10-diol
OPENEYE Name: 9,10-dimethyl-1,8-bis(phenylsulfanyl)anthracene-9,10-diol
IUPAC Name: 9,10-dimethyl-1,8-bis(phenylsulfanyl)anthracene-9,10-diol
SYSTEMATIC NAME: 9,10-dimethyl-1,8-bis(phenylsulfanyl)anthracene-9,10-diol
MOLECULAR FORMULA: C28H24O2S2
MOLECULAR WEIGHT: 456.61896
SMILES: CC1(C2=C(C(=CC=C2)SC3=CC=CC=C3)C(C4=C1C=CC=C4SC5=CC=CC=C5)(C)O)O
Structure:
CAS RN: 64219-22-3
CAS Name: 4-(3,12-diacetyloxy-10,13-dimethyl-6-oxo-1,2,3,4,5,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid methyl ester
OPENEYE Name: methyl 4-(3,12-diacetoxy-10,13-dimethyl-6-oxo-1,2,3,4,5,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)pentanoate
IUPAC Name: methyl 4-(3,12-diacetyloxy-10,13-dimethyl-6-oxo-1,2,3,4,5,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)pentanoate
SYSTEMATIC NAME: methyl 4-(3,12-diacetyloxy-10,13-dimethyl-6-oxidanylidene-1,2,3,4,5,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)pentanoate
MOLECULAR FORMULA: C29H42O7
MOLECULAR WEIGHT: 502.63958
SMILES: CC(CCC(=O)OC)C1CCC2C1(C(CC3C2=CC(=O)C4C3(CCC(C4)OC(=O)C)C)OC(=O)C)C
Structure:
CAS RN: 63160-13-4
CAS Name: 2-(benzenesulfonyl)-3-phenyloxaziridine
OPENEYE Name: 2-(benzenesulfonyl)-3-phenyl-oxaziridine
IUPAC Name: 2-(benzenesulfonyl)-3-phenyloxaziridine
SYSTEMATIC NAME: 3-phenyl-2-(phenylsulfonyl)-1,2-oxaziridine
MOLECULAR FORMULA: C13H11NO3S
MOLECULAR WEIGHT: 261.29634
SMILES: C1=CC=C(C=C1)C2N(O2)S(=O)(=O)C3=CC=CC=C3
Structure:
CAS RN: 40576-72-5
CAS Name: N-(2-methylpropylidene)-3-nitrobenzenesulfenamide
OPENEYE Name: 2-methyl-N-(3-nitrophenyl)sulfanyl-propan-1-imine
IUPAC Name: 2-methyl-N-(3-nitrophenyl)sulfanylpropan-1-imine
SYSTEMATIC NAME: 2-methyl-N-(3-nitrophenyl)sulfanyl-propan-1-imine
MOLECULAR FORMULA: C10H12N2O2S
MOLECULAR WEIGHT: 224.27948
SMILES: CC(C)C=NSC1=CC=CC(=C1)[N+](=O)[O-]
Structure:
CAS RN: 63160-16-7
CAS Name: 4-nitro-N-(phenylmethylene)benzenesulfonamide
OPENEYE Name: N-benzylidene-4-nitro-benzenesulfonamide
IUPAC Name: N-benzylidene-4-nitrobenzenesulfonamide
SYSTEMATIC NAME: 4-nitro-N-(phenylmethylidene)benzenesulfonamide
MOLECULAR FORMULA: C13H10N2O4S
MOLECULAR WEIGHT: 290.2945
SMILES: C1=CC=C(C=C1)C=NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]
Structure:
CAS RN: 53075-89-1
CAS Name: 4-chloro-N-(phenylmethylene)benzenesulfinamide
OPENEYE Name: N-benzylidene-4-chloro-benzenesulfinamide
IUPAC Name: N-benzylidene-4-chlorobenzenesulfinamide
SYSTEMATIC NAME: 4-chloranyl-N-(phenylmethylidene)benzenesulfinamide
MOLECULAR FORMULA: C13H10ClNOS
MOLECULAR WEIGHT: 263.7426
SMILES: C1=CC=C(C=C1)C=NS(=O)C2=CC=C(C=C2)Cl
Structure:
CAS RN: 53075-86-8
CAS Name: 4-chloro-N-(phenylmethylene)benzenesulfenamide
OPENEYE Name: N-(4-chlorophenyl)sulfanyl-1-phenyl-methanimine
IUPAC Name: N-(4-chlorophenyl)sulfanyl-1-phenylmethanimine
SYSTEMATIC NAME: N-(4-chlorophenyl)sulfanyl-1-phenyl-methanimine
MOLECULAR FORMULA: C13H10ClNS
MOLECULAR WEIGHT: 247.7432
SMILES: C1=CC=C(C=C1)C=NSC2=CC=C(C=C2)Cl
Structure:
CAS RN: 64377-92-0
CAS Name: 5-(3-methyl-1,4-dioxo-2-phthalazinyl)-N-propan-2-ylpentanamide
OPENEYE Name: N-isopropyl-5-(3-methyl-1,4-dioxo-phthalazin-2-yl)pentanamide
IUPAC Name: 5-(3-methyl-1,4-dioxophthalazin-2-yl)-N-propan-2-ylpentanamide
SYSTEMATIC NAME: 5-[3-methyl-1,4-bis(oxidanylidene)phthalazin-2-yl]-N-propan-2-yl-pentanamide
MOLECULAR FORMULA: C17H23N3O3
MOLECULAR WEIGHT: 317.38282
SMILES: CC(C)NC(=O)CCCCN1C(=O)C2=CC=CC=C2C(=O)N1C
Structure:
CAS RN: 64377-91-9
CAS Name: 4-(3-methyl-1,4-dioxo-2-phthalazinyl)-N-propan-2-ylbutanamide
OPENEYE Name: N-isopropyl-4-(3-methyl-1,4-dioxo-phthalazin-2-yl)butanamide
IUPAC Name: 4-(3-methyl-1,4-dioxophthalazin-2-yl)-N-propan-2-ylbutanamide
SYSTEMATIC NAME: 4-[3-methyl-1,4-bis(oxidanylidene)phthalazin-2-yl]-N-propan-2-yl-butanamide
MOLECULAR FORMULA: C16H21N3O3
MOLECULAR WEIGHT: 303.35624
SMILES: CC(C)NC(=O)CCCN1C(=O)C2=CC=CC=C2C(=O)N1C
Structure:
CAS RN: 64377-90-8
CAS Name: 3-(3-methyl-1,4-dioxo-2-phthalazinyl)-N-propan-2-ylpropanamide
OPENEYE Name: N-isopropyl-3-(3-methyl-1,4-dioxo-phthalazin-2-yl)propanamide
IUPAC Name: 3-(3-methyl-1,4-dioxophthalazin-2-yl)-N-propan-2-ylpropanamide
SYSTEMATIC NAME: 3-[3-methyl-1,4-bis(oxidanylidene)phthalazin-2-yl]-N-propan-2-yl-propanamide
MOLECULAR FORMULA: C15H19N3O3
MOLECULAR WEIGHT: 289.32966
SMILES: CC(C)NC(=O)CCN1C(=O)C2=CC=CC=C2C(=O)N1C
Structure:
CAS RN: 64949-86-6
CAS Name: 2-[(3-benzamido-1-oxopropyl)amino]-3-[(triphenylmethyl)thio]propanoic acid ethyl ester
OPENEYE Name: ethyl 2-(3-benzamidopropanoylamino)-3-tritylsulfanyl-propanoate
IUPAC Name: ethyl 2-(3-benzamidopropanoylamino)-3-tritylsulfanylpropanoate
SYSTEMATIC NAME: ethyl 2-(3-benzamidopropanoylamino)-3-(triphenylmethyl)sulfanyl-propanoate
MOLECULAR FORMULA: C34H34N2O4S
MOLECULAR WEIGHT: 566.70976
SMILES: CCOC(=O)C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)NC(=O)CCNC(=O)C4=CC=CC=C4
Structure:
CAS RN: 65263-76-5
CAS Name: 4-[amino-[bis(2-chloroethyl)amino]phosphoryl]oxy-2-hydroxybutanenitrile
OPENEYE Name: 4-[amino-[bis(2-chloroethyl)amino]phosphoryl]oxy-2-hydroxy-butanenitrile
IUPAC Name: 4-[amino-[bis(2-chloroethyl)amino]phosphoryl]oxy-2-hydroxybutanenitrile
SYSTEMATIC NAME: 4-[azanyl-[bis(2-chloroethyl)amino]phosphoryl]oxy-2-oxidanyl-butanenitrile
MOLECULAR FORMULA: C8H16Cl2N3O3P
MOLECULAR WEIGHT: 304.110701
SMILES: C(COP(=O)(N)N(CCCl)CCCl)C(C#N)O
Structure:
CAS RN: 76675-92-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C33H38O7
MOLECULAR WEIGHT: 546.65062
SMILES: CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C35C(O5)C(C4C6=COC(=O)C=C6)OC(=O)C7=CC=CC=C7)C)C
Structure:
CAS RN: 76675-91-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H44O7
MOLECULAR WEIGHT: 540.68756
SMILES: CCCCCC(=O)OC1C(C2(CCC3C(C24C1O4)CCC5C3(CCC(C5)OC(=O)C)C)C)C6=COC(=O)C=C6
Structure:
CAS RN: 76675-90-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C31H42O7
MOLECULAR WEIGHT: 526.66098
SMILES: CC(C)CC(=O)OC1C(C2(CCC3C(C24C1O4)CCC5C3(CCC(C5)OC(=O)C)C)C)C6=COC(=O)C=C6
Structure:
CAS RN: 76675-89-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C31H42O7
MOLECULAR WEIGHT: 526.66098
SMILES: CCCCC(=O)OC1C(C2(CCC3C(C24C1O4)CCC5C3(CCC(C5)OC(=O)C)C)C)C6=COC(=O)C=C6
Structure:
CAS RN: 76685-42-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H40O7
MOLECULAR WEIGHT: 512.6344
SMILES: CCCC(=O)OC1C(C2(CCC3C(C24C1O4)CCC5C3(CCC(C5)OC(=O)C)C)C)C6=COC(=O)C=C6
Structure:
CAS RN: 76675-88-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H38O7
MOLECULAR WEIGHT: 498.60782
SMILES: CCC(=O)OC1C(C2(CCC3C(C24C1O4)CCC5C3(CCC(C5)OC(=O)C)C)C)C6=COC(=O)C=C6
Structure:
CAS RN: 5035-10-9
CAS Name: (3S,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-aminoethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
OPENEYE Name: (3S,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-aminoethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
IUPAC Name: (3S,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-aminoethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SYSTEMATIC NAME: (3S,8S,9S,10R,13S,14S,17S)-17-[(1S)-1-azanylethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
MOLECULAR FORMULA: C21H35NO
MOLECULAR WEIGHT: 317.5087
SMILES: C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)N
Structure:
CAS RN: 6704-71-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H33NO
MOLECULAR WEIGHT: 315.49282
SMILES: CC1C2CCC3C2(CCC4C3CC=C5C4(CCC(C5)O)C)CN1
Structure:
CAS RN: 63700-40-3
CAS Name: (5R,5aR,8aR)-5-(3,4-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-6-one
OPENEYE Name: (5R,5aR,8aR)-5-(3,4-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-6-one
IUPAC Name: (5R,5aR,8aR)-5-(3,4-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-6-one
SYSTEMATIC NAME: (5R,5aR,8aR)-5-(3,4-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-6-one
MOLECULAR FORMULA: C21H20O6
MOLECULAR WEIGHT: 368.3799
SMILES: COC1=C(C=C(C=C1)[C@H]2[C@@H]3[C@@H](CC4=CC5=C(C=C24)OCO5)COC3=O)OC
Structure:
CAS RN: 481-87-8
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H24N2
MOLECULAR WEIGHT: 280.40726
SMILES: CC[C@@H]1C[C@H]2CC3C1N(C2)CCC4=C3NC5=CC=CC=C45
Structure:
CAS RN: 62523-07-3
CAS Name: N-cyclohexylcarbamic acid [2-[[(cyclohexylamino)-oxomethoxy]methyl]-3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl ester
OPENEYE Name: [2-(cyclohexylcarbamoyloxymethyl)-3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-cyclohexylcarbamate
IUPAC Name: [2-(cyclohexylcarbamoyloxymethyl)-3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-cyclohexylcarbamate
SYSTEMATIC NAME: [2-(cyclohexylcarbamoyloxymethyl)-3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-cyclohexylcarbamate
MOLECULAR FORMULA: C29H37Cl2N3O4
MOLECULAR WEIGHT: 562.52778
SMILES: C1CCC(CC1)NC(=O)OCC2=C3CCCN3C(=C2COC(=O)NC4CCCCC4)C5=CC(=C(C=C5)Cl)Cl
Structure:
CAS RN: 62522-85-4
CAS Name: N-butylcarbamic acid [2-[[butylamino(oxo)methoxy]methyl]-3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl ester
OPENEYE Name: [2-(butylcarbamoyloxymethyl)-3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-butylcarbamate
IUPAC Name: [2-(butylcarbamoyloxymethyl)-3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-butylcarbamate
SYSTEMATIC NAME: [2-(butylcarbamoyloxymethyl)-3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-butylcarbamate
MOLECULAR FORMULA: C25H33Cl2N3O4
MOLECULAR WEIGHT: 510.45322
SMILES: CCCCNC(=O)OCC1=C2CCCN2C(=C1COC(=O)NCCCC)C3=CC(=C(C=C3)Cl)Cl
Structure:
CAS RN: 62523-06-2
CAS Name: N-ethylcarbamic acid [3-(3,4-dichlorophenyl)-2-(ethylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl ester
OPENEYE Name: [3-(3,4-dichlorophenyl)-2-(ethylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-ethylcarbamate
IUPAC Name: [3-(3,4-dichlorophenyl)-2-(ethylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-ethylcarbamate
SYSTEMATIC NAME: [3-(3,4-dichlorophenyl)-2-(ethylcarbamoyloxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methyl N-ethylcarbamate
MOLECULAR FORMULA: C21H25Cl2N3O4
MOLECULAR WEIGHT: 454.3469
SMILES: CCNC(=O)OCC1=C2CCCN2C(=C1COC(=O)NCC)C3=CC(=C(C=C3)Cl)Cl
Structure:
CAS RN: 62522-89-8
CAS Name: [3-(3,4-dichlorophenyl)-2-(hydroxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methanol
OPENEYE Name: [3-(3,4-dichlorophenyl)-2-(hydroxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methanol
IUPAC Name: [3-(3,4-dichlorophenyl)-2-(hydroxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methanol
SYSTEMATIC NAME: [3-(3,4-dichlorophenyl)-2-(hydroxymethyl)-6,7-dihydro-5H-pyrrolizin-1-yl]methanol
MOLECULAR FORMULA: C15H15Cl2NO2
MOLECULAR WEIGHT: 312.1911
SMILES: C1CC2=C(C(=C(N2C1)C3=CC(=C(C=C3)Cl)Cl)CO)CO
Structure:
CAS RN: 62522-87-6
CAS Name: 3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylic acid dimethyl ester
OPENEYE Name: dimethyl 3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate
IUPAC Name: dimethyl 3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate
SYSTEMATIC NAME: dimethyl 3-(3,4-dichlorophenyl)-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate
MOLECULAR FORMULA: C17H15Cl2NO4
MOLECULAR WEIGHT: 368.2113
SMILES: COC(=O)C1=C2CCCN2C(=C1C(=O)OC)C3=CC(=C(C=C3)Cl)Cl
Structure:
CAS RN: 10387-50-5
CAS Name: 7-(3-methylbut-2-enoxy)-1-benzopyran-2-one
OPENEYE Name: 7-(3-methylbut-2-enoxy)chromen-2-one
IUPAC Name: 7-(3-methylbut-2-enoxy)chromen-2-one
SYSTEMATIC NAME: 7-(3-methylbut-2-enoxy)chromen-2-one
MOLECULAR FORMULA: C14H14O3
MOLECULAR WEIGHT: 230.25916
SMILES: CC(=CCOC1=CC2=C(C=C1)C=CC(=O)O2)C
Structure:
CAS RN: 16745-06-5
CAS Name: 3,4-dihydroxy-1-(6-hydroxy-5-methyl-1,4-dihydropyrazin-2-yl)-2-butanone
OPENEYE Name: 3,4-dihydroxy-1-(6-hydroxy-5-methyl-1,4-dihydropyrazin-2-yl)butan-2-one
IUPAC Name: 3,4-dihydroxy-1-(6-hydroxy-5-methyl-1,4-dihydropyrazin-2-yl)butan-2-one
SYSTEMATIC NAME: 1-(5-methyl-6-oxidanyl-1,4-dihydropyrazin-2-yl)-3,4-bis(oxidanyl)butan-2-one
MOLECULAR FORMULA: C9H14N2O4
MOLECULAR WEIGHT: 214.21846
SMILES: CC1=C(NC(=CN1)CC(=O)C(CO)O)O
Structure:
CAS RN: 16684-36-9
CAS Name: N-[1-oxo-1-[[2,4,5-trihydroxy-6-(hydroxymethyl)-3-oxanyl]amino]propan-2-yl]carbamic acid (phenylmethyl) ester
OPENEYE Name: benzyl N-[1-methyl-2-oxo-2-[[2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]amino]ethyl]carbamate
IUPAC Name: benzyl N-[1-oxo-1-[[2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]amino]propan-2-yl]carbamate
SYSTEMATIC NAME: (phenylmethyl) N-[1-[[6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]amino]-1-oxidanylidene-propan-2-yl]carbamate
MOLECULAR FORMULA: C17H24N2O8
MOLECULAR WEIGHT: 384.38106
SMILES: CC(C(=O)NC1C(C(C(OC1O)CO)O)O)NC(=O)OCC2=CC=CC=C2
Structure:
CAS RN: 69164-72-3
CAS Name: 4-(hydroxysulfamoyl)-2-(phenylmethoxycarbonylamino)butanoic acid (phenylmethyl) ester
OPENEYE Name: benzyl 2-(benzyloxycarbonylamino)-4-(hydroxysulfamoyl)butanoate
IUPAC Name: benzyl 4-(hydroxysulfamoyl)-2-(phenylmethoxycarbonylamino)butanoate
SYSTEMATIC NAME: (phenylmethyl) 4-(oxidanylsulfamoyl)-2-(phenylmethoxycarbonylamino)butanoate
MOLECULAR FORMULA: C19H22N2O7S
MOLECULAR WEIGHT: 422.45218
SMILES: C1=CC=C(C=C1)COC(=O)C(CCS(=O)(=O)NO)NC(=O)OCC2=CC=CC=C2
Structure:
CAS RN: 29071-92-9
CAS Name: N-(3-pyridinylmethylideneamino)methanamine
OPENEYE Name: N-(3-pyridylmethyleneamino)methanamine
IUPAC Name: N-(pyridin-3-ylmethylideneamino)methanamine
SYSTEMATIC NAME: N-(pyridin-3-ylmethylideneamino)methanamine
MOLECULAR FORMULA: C7H9N3
MOLECULAR WEIGHT: 135.16646
SMILES: CNN=CC1=CN=CC=C1
Structure:
CAS RN: 62356-52-9
CAS Name: 4-hydroxy-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione
OPENEYE Name: 4-hydroxy-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione
IUPAC Name: 4-hydroxy-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione
SYSTEMATIC NAME: 4-oxidanyl-5,6-dihydro-4H-cyclopenta[c]pyrrole-1,3-dione
MOLECULAR FORMULA: C7H7NO3
MOLECULAR WEIGHT: 153.13538
SMILES: C1CC2=C(C1O)C(=O)NC2=O
Structure:
CAS RN: 56750-98-2
CAS Name: 1-(1,3-benzodioxol-5-yl)-1-nonen-3-one
OPENEYE Name: 1-(1,3-benzodioxol-5-yl)non-1-en-3-one
IUPAC Name: 1-(1,3-benzodioxol-5-yl)non-1-en-3-one
SYSTEMATIC NAME: 1-(1,3-benzodioxol-5-yl)non-1-en-3-one
MOLECULAR FORMULA: C16H20O3
MOLECULAR WEIGHT: 260.3282
SMILES: CCCCCCC(=O)C=CC1=CC2=C(C=C1)OCO2
Structure:
CAS RN: 55170-66-6
CAS Name: 1-[2-oxo-3-(2-oxo-1-quinolinyl)propyl]-2-quinolinone
OPENEYE Name: 1-[2-oxo-3-(2-oxo-1-quinolyl)propyl]quinolin-2-one
IUPAC Name: 1-[2-oxo-3-(2-oxoquinolin-1-yl)propyl]quinolin-2-one
SYSTEMATIC NAME: 1-[2-oxidanylidene-3-(2-oxidanylidenequinolin-1-yl)propyl]quinolin-2-one
MOLECULAR FORMULA: C21H16N2O3
MOLECULAR WEIGHT: 344.36334
SMILES: C1=CC=C2C(=C1)C=CC(=O)N2CC(=O)CN3C(=O)C=CC4=CC=CC=C43
Structure:
CAS RN: 83291-30-9
CAS Name: N-[5-amino-3-[(N-methylanilino)methyl]-1,2,3,4-tetrahydropyrido[3,4-b]pyrazin-7-yl]carbamic acid ethyl ester
OPENEYE Name: ethyl N-[5-amino-3-[(N-methylanilino)methyl]-1,2,3,4-tetrahydropyrido[3,4-b]pyrazin-7-yl]carbamate
IUPAC Name: ethyl N-[5-amino-3-[(N-methylanilino)methyl]-1,2,3,4-tetrahydropyrido[3,4-b]pyrazin-7-yl]carbamate
SYSTEMATIC NAME: ethyl N-[5-azanyl-3-[[methyl(phenyl)amino]methyl]-1,2,3,4-tetrahydropyrido[3,4-b]pyrazin-7-yl]carbamate
MOLECULAR FORMULA: C18H24N6O2
MOLECULAR WEIGHT: 356.42216
SMILES: CCOC(=O)NC1=NC(=C2C(=C1)NCC(N2)CN(C)C3=CC=CC=C3)N
Structure:
CAS RN: 62102-31-2
CAS Name: 1-[2-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione
OPENEYE Name: 1-[2-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione
IUPAC Name: 1-[2-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione
SYSTEMATIC NAME: 1-[4-(hydroxymethyl)-2-oxidanyl-cyclopentyl]pyrimidine-2,4-dione
MOLECULAR FORMULA: C10H14N2O4
MOLECULAR WEIGHT: 226.22916
SMILES: C1C(CC(C1N2C=CC(=O)NC2=O)O)CO
Structure:
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