CAS RN: 84210-80-0
CAS Name: 2-[[(2S,4R)-2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphosphorinan-4-yl]thio]ethanesulfonic acid; cyclohexanamine
OPENEYE Name: 2-[[(2S,4R)-2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphosphinan-4-yl]sulfanyl]ethanesulfonic acid; cyclohexanamine
IUPAC Name: 2-[[(2S,4R)-2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2$l^{5}-oxazaphosphinan-4-yl]sulfanyl]ethanesulfonic acid; cyclohexanamine
SYSTEMATIC NAME: 2-[[(2S,4R)-2-[bis(2-chloroethyl)amino]-2-oxidanylidene-1,3,2$l^{5}-oxazaphosphinan-4-yl]sulfanyl]ethanesulfonic acid; cyclohexanamine
MOLECULAR FORMULA: C15H32Cl2N3O5PS2
MOLECULAR WEIGHT: 500.441441
SMILES: C1CCC(CC1)N.C1CO[P@@](=O)(N[C@@H]1SCCS(=O)(=O)O)N(CCCl)CCCl
Structure:
CAS RN: 94374-07-9
CAS Name: N-phenyl-N-[2-(1-piperidinyl)propyl]ethanesulfonamide
OPENEYE Name: N-phenyl-N-[2-(1-piperidyl)propyl]ethanesulfonamide
IUPAC Name: N-phenyl-N-(2-piperidin-1-ylpropyl)ethanesulfonamide
SYSTEMATIC NAME: N-phenyl-N-(2-piperidin-1-ylpropyl)ethanesulfonamide
MOLECULAR FORMULA: C16H26N2O2S
MOLECULAR WEIGHT: 310.45484
SMILES: CCS(=O)(=O)N(CC(C)N1CCCCC1)C2=CC=CC=C2
Structure:
CAS RN: 94501-76-5
CAS Name: N-[2-(4-morpholinyl)propyl]-N-phenylethanesulfonamide
OPENEYE Name: N-(2-morpholinopropyl)-N-phenyl-ethanesulfonamide
IUPAC Name: N-(2-morpholin-4-ylpropyl)-N-phenylethanesulfonamide
SYSTEMATIC NAME: N-(2-morpholin-4-ylpropyl)-N-phenyl-ethanesulfonamide
MOLECULAR FORMULA: C15H24N2O3S
MOLECULAR WEIGHT: 312.42766
SMILES: CCS(=O)(=O)N(CC(C)N1CCOCC1)C2=CC=CC=C2
Structure:
CAS RN: 93162-20-0
CAS Name: N-phenyl-N-[1-(1-piperidinyl)propan-2-yl]ethanesulfonamide
OPENEYE Name: N-[1-methyl-2-(1-piperidyl)ethyl]-N-phenyl-ethanesulfonamide
IUPAC Name: N-phenyl-N-(1-piperidin-1-ylpropan-2-yl)ethanesulfonamide
SYSTEMATIC NAME: N-phenyl-N-(1-piperidin-1-ylpropan-2-yl)ethanesulfonamide
MOLECULAR FORMULA: C16H26N2O2S
MOLECULAR WEIGHT: 310.45484
SMILES: CCS(=O)(=O)N(C1=CC=CC=C1)C(C)CN2CCCCC2
Structure:
CAS RN: 94687-49-7
CAS Name: N-[2-[methyl(2-phenylethyl)amino]propyl]-N-phenylethanesulfonamide
OPENEYE Name: N-[2-[methyl(2-phenylethyl)amino]propyl]-N-phenyl-ethanesulfonamide
IUPAC Name: N-[2-[methyl(2-phenylethyl)amino]propyl]-N-phenylethanesulfonamide
SYSTEMATIC NAME: N-[2-[methyl(2-phenylethyl)amino]propyl]-N-phenyl-ethanesulfonamide
MOLECULAR FORMULA: C20H28N2O2S
MOLECULAR WEIGHT: 360.51352
SMILES: CCS(=O)(=O)N(CC(C)N(C)CCC1=CC=CC=C1)C2=CC=CC=C2
Structure:
CAS RN: 91893-56-0
CAS Name: 1-(2-chloroethyl)-3-[2-[2-hydroxyethyl(methyl)sulfamoyl]ethyl]-1-nitrosourea
OPENEYE Name: 1-(2-chloroethyl)-3-[2-[2-hydroxyethyl(methyl)sulfamoyl]ethyl]-1-nitroso-urea
IUPAC Name: 1-(2-chloroethyl)-3-[2-[2-hydroxyethyl(methyl)sulfamoyl]ethyl]-1-nitrosourea
SYSTEMATIC NAME: 1-(2-chloroethyl)-3-[2-[2-hydroxyethyl(methyl)sulfamoyl]ethyl]-1-nitroso-urea
MOLECULAR FORMULA: C8H17ClN4O5S
MOLECULAR WEIGHT: 316.76238
SMILES: CN(CCO)S(=O)(=O)CCNC(=O)N(CCCl)N=O
Structure:
CAS RN: 95968-67-5
CAS Name: N-(5,11-dihydro-[1]benzoxepino[3,4-b]pyridin-11-yl)-N',N'-dimethylethane-1,2-diamine hydrate hexahydrochloride
OPENEYE Name: N-(5,11-dihydro-[1]benzoxepino[3,4-b]pyridin-11-yl)-N',N'-dimethyl-ethane-1,2-diamine hydrate hexahydrochloride
IUPAC Name: N-(5,11-dihydro-[1]benzoxepino[3,4-b]pyridin-11-yl)-N',N'-dimethylethane-1,2-diamine hydrate hexahydrochloride
SYSTEMATIC NAME: N-(5,11-dihydro-[1]benzoxepino[3,4-b]pyridin-11-yl)-N',N'-dimethyl-ethane-1,2-diamine hydrate hexahydrochloride
MOLECULAR FORMULA: C34H50Cl6N6O3
MOLECULAR WEIGHT: 803.5172
SMILES: CN(C)CCNC1C2=C(COC3=CC=CC=C13)N=CC=C2.CN(C)CCNC1C2=C(COC3=CC=CC=C13)N=CC=C2.O.Cl.Cl.Cl.Cl.Cl.Cl
Structure:
CAS RN: 95968-34-6
CAS Name: N-(5,11-dihydro-[1]benzoxepino[3,4-b]pyridin-11-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine hydrate hexahydrochloride
OPENEYE Name: N-(5,11-dihydro-[1]benzoxepino[3,4-b]pyridin-11-yl)-N',N'-diisopropyl-ethane-1,2-diamine hydrate hexahydrochloride
IUPAC Name: N-(5,11-dihydro-[1]benzoxepino[3,4-b]pyridin-11-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine hydrate hexahydrochloride
SYSTEMATIC NAME: N-(5,11-dihydro-[1]benzoxepino[3,4-b]pyridin-11-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine hydrate hexahydrochloride
MOLECULAR FORMULA: C42H66Cl6N6O3
MOLECULAR WEIGHT: 915.72984
SMILES: CC(C)N(CCNC1C2=C(COC3=CC=CC=C13)N=CC=C2)C(C)C.CC(C)N(CCNC1C2=C(COC3=CC=CC=C13)N=CC=C2)C(C)C.O.Cl.Cl.Cl.Cl.Cl.Cl
Structure:
CAS RN: 102147-09-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H56Cl4N6O5
MOLECULAR WEIGHT: 770.65764
SMILES: CCN(CC)CCNC1=NC2=CC=CC3=C2C1=CC=C3.CCN(CC)CCNC1=NC2=CC=CC3=C2C1=CC=C3.O.O.O.O.O.Cl.Cl.Cl.Cl
Structure:
CAS RN: 94221-67-7
CAS Name: (E)-2-butenedioic acid; 1-methyl-N-(2-phenoxyethyl)-4-phenyl-2-pyrrolidinimine
OPENEYE Name: fumaric acid; 1-methyl-N-(2-phenoxyethyl)-4-phenyl-pyrrolidin-2-imine
IUPAC Name: (E)-but-2-enedioic acid; 1-methyl-N-(2-phenoxyethyl)-4-phenylpyrrolidin-2-imine
SYSTEMATIC NAME: (E)-but-2-enedioic acid; 1-methyl-N-(2-phenoxyethyl)-4-phenyl-pyrrolidin-2-imine
MOLECULAR FORMULA: C23H26N2O5
MOLECULAR WEIGHT: 410.46294
SMILES: CN1CC(CC1=NCCOC2=CC=CC=C2)C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 94221-93-9
CAS Name: 4-(2-benzofuranyl)-1-methyl-N-(2-phenoxyethyl)-2-pyrrolidinimine; (E)-2-butenedioic acid
OPENEYE Name: 4-(benzofuran-2-yl)-1-methyl-N-(2-phenoxyethyl)pyrrolidin-2-imine; fumaric acid
IUPAC Name: 4-(1-benzofuran-2-yl)-1-methyl-N-(2-phenoxyethyl)pyrrolidin-2-imine; (E)-but-2-enedioic acid
SYSTEMATIC NAME: 4-(1-benzofuran-2-yl)-1-methyl-N-(2-phenoxyethyl)pyrrolidin-2-imine; (E)-but-2-enedioic acid
MOLECULAR FORMULA: C25H26N2O6
MOLECULAR WEIGHT: 450.48374
SMILES: CN1CC(CC1=NCCOC2=CC=CC=C2)C3=CC4=CC=CC=C4O3.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 94221-88-2
CAS Name: 4-(2-benzofuranyl)-N-(2-methoxyethyl)-1-methyl-2-pyrrolidinimine; (E)-2-butenedioic acid
OPENEYE Name: 4-(benzofuran-2-yl)-N-(2-methoxyethyl)-1-methyl-pyrrolidin-2-imine; fumaric acid
IUPAC Name: 4-(1-benzofuran-2-yl)-N-(2-methoxyethyl)-1-methylpyrrolidin-2-imine; (E)-but-2-enedioic acid
SYSTEMATIC NAME: 4-(1-benzofuran-2-yl)-N-(2-methoxyethyl)-1-methyl-pyrrolidin-2-imine; (E)-but-2-enedioic acid
MOLECULAR FORMULA: C20H24N2O6
MOLECULAR WEIGHT: 388.41436
SMILES: CN1CC(CC1=NCCOC)C2=CC3=CC=CC=C3O2.C(=C/C(=O)O)\C(=O)O
Structure:
CAS RN: 102489-76-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H43N5O11
MOLECULAR WEIGHT: 697.73212
SMILES: CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C)NC(=O)[C@H]4CN([C@@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O.C(C(C(=O)O)O)(C(=O)O)O
Structure:
CAS RN: 115178-31-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C20H24N4
MOLECULAR WEIGHT: 320.43136
SMILES: CC1=NC=CN1C[C@H]2CC3[C@@H](CC4=CNC5=CC=CC3=C45)N(C2)C
Structure:
CAS RN: 96724-09-3
CAS Name: (11Z,14Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]eicosa-11,14-dienamide
OPENEYE Name: (11Z,14Z)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]icosa-11,14-dienamide
IUPAC Name: (11Z,14Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]icosa-11,14-dienamide
SYSTEMATIC NAME: (11Z,14Z)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]icosa-11,14-dienamide
MOLECULAR FORMULA: C28H45NO3
MOLECULAR WEIGHT: 443.6618
SMILES: CCCCC/C=C\C/C=C\CCCCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 95548-16-6
CAS Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-9-dodecenamide
OPENEYE Name: (Z)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]dodec-9-enamide
IUPAC Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]dodec-9-enamide
SYSTEMATIC NAME: (Z)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]dodec-9-enamide
MOLECULAR FORMULA: C20H31NO3
MOLECULAR WEIGHT: 333.46504
SMILES: CC/C=C\CCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 95548-17-7
CAS Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-13-docosenamide
OPENEYE Name: (Z)-N-[(4-hydroxy-3-methoxy-phenyl)methyl]docos-13-enamide
IUPAC Name: (Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]docos-13-enamide
SYSTEMATIC NAME: (Z)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]docos-13-enamide
MOLECULAR FORMULA: C30H51NO3
MOLECULAR WEIGHT: 473.73084
SMILES: CCCCCCCC/C=C\CCCCCCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC
Structure:
CAS RN: 94339-35-2
CAS Name: 3-(5-methoxypentan-2-yl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c][1]benzopyran-1,9-diol
OPENEYE Name: 3-(4-methoxy-1-methyl-butyl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromene-1,9-diol
IUPAC Name: 3-(5-methoxypentan-2-yl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromene-1,9-diol
SYSTEMATIC NAME: 3-(5-methoxypentan-2-yl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromene-1,9-diol
MOLECULAR FORMULA: C21H32O4
MOLECULAR WEIGHT: 348.47638
SMILES: CC(CCCOC)C1=CC2=C(C3CC(CCC3C(O2)(C)C)O)C(=C1)O
Structure:
CAS RN: 94339-41-0
CAS Name: 3-(5-ethoxypentan-2-yl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c][1]benzopyran-1,9-diol
OPENEYE Name: 3-(4-ethoxy-1-methyl-butyl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromene-1,9-diol
IUPAC Name: 3-(5-ethoxypentan-2-yl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromene-1,9-diol
SYSTEMATIC NAME: 3-(5-ethoxypentan-2-yl)-6,6-dimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromene-1,9-diol
MOLECULAR FORMULA: C22H34O4
MOLECULAR WEIGHT: 362.50296
SMILES: CCOCCCC(C)C1=CC2=C(C3CC(CCC3C(O2)(C)C)O)C(=C1)O
Structure:
CAS RN: 93696-98-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H21NO5
MOLECULAR WEIGHT: 367.39514
SMILES: CNCCCC1=CC(=O)C2=CC=CC=C2C3=CC=CC=C31.C(=O)(C(=O)O)O
Structure:
CAS RN: 93696-94-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H23NO5
MOLECULAR WEIGHT: 381.42172
SMILES: CN(C)CCCC1=CC(=O)C2=CC=CC=C2C3=CC=CC=C31.C(=O)(C(=O)O)O
Structure:
CAS RN: 93696-96-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H27NO5
MOLECULAR WEIGHT: 409.47488
SMILES: CCN(CC)CCCC1=CC(=O)C2=CC=CC=C2C3=CC=CC=C31.C(=O)(C(=O)O)O
Structure:
CAS RN: 93696-92-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C21H24ClNO2
MOLECULAR WEIGHT: 357.87376
SMILES: CCN(CC)CCOC1=CC(=O)C2=CC=CC=C2C3=CC=CC=C31.Cl
Structure:
CAS RN: 94372-84-6
CAS Name: 3,9-bis(2-oxiranylmethyl)-3,9-diazaspiro[5.5]undecane
OPENEYE Name: 3,9-bis(oxiran-2-ylmethyl)-3,9-diazaspiro[5.5]undecane
IUPAC Name: 3,9-bis(oxiran-2-ylmethyl)-3,9-diazaspiro[5.5]undecane
SYSTEMATIC NAME: 3,9-bis(oxiran-2-ylmethyl)-3,9-diazaspiro[5.5]undecane
MOLECULAR FORMULA: C15H26N2O2
MOLECULAR WEIGHT: 266.37914
SMILES: C1CN(CCC12CCN(CC2)CC3CO3)CC4CO4
Structure:
CAS RN: 95461-33-9
CAS Name: 3-bromo-1-[12-(3-bromo-2-methyl-1-oxopropyl)-3,12-diaza-6,9-diazoniadispiro[5.2.5^{9}.2^{6}]hexadecan-3-yl]-2-methyl-1-propanone dichloride hydrate
OPENEYE Name: 3-bromo-1-[12-(3-bromo-2-methyl-propanoyl)-3,12-diaza-6,9-diazoniadispiro[5.2.5^{9}.2^{6}]hexadecan-3-yl]-2-methyl-propan-1-one dichloride hydrate
IUPAC Name: 3-bromo-1-[12-(3-bromo-2-methylpropanoyl)-3,12-diaza-6,9-diazoniadispiro[5.2.5^{9}.2^{6}]hexadecan-3-yl]-2-methylpropan-1-one dichloride hydrate
SYSTEMATIC NAME: 3-bromanyl-1-[12-(3-bromanyl-2-methyl-propanoyl)-3,12-diaza-6,9-diazoniadispiro[5.2.5^{9}.2^{6}]hexadecan-3-yl]-2-methyl-propan-1-one dichloride hydrate
MOLECULAR FORMULA: C20H38Br2Cl2N4O3
MOLECULAR WEIGHT: 613.25472
SMILES: CC(CBr)C(=O)N1CC[N+]2(CC1)CC[N+]3(CCN(CC3)C(=O)C(C)CBr)CC2.O.[Cl-].[Cl-]
Structure:
CAS RN: 97669-74-4
CAS Name: N-(4-methoxyphenyl)carbamic acid [(E)-[3-[8-(1-oxopropyl)-3,8-diazabicyclo[3.2.1]octan-3-yl]-3-phenylpropylidene]amino] ester hydrochloride
OPENEYE Name: [(E)-[3-phenyl-3-(8-propanoyl-3,8-diazabicyclo[3.2.1]octan-3-yl)propylidene]amino] N-(4-methoxyphenyl)carbamate hydrochloride
IUPAC Name: [(E)-[3-phenyl-3-(8-propanoyl-3,8-diazabicyclo[3.2.1]octan-3-yl)propylidene]amino] N-(4-methoxyphenyl)carbamate hydrochloride
SYSTEMATIC NAME: [(E)-[3-phenyl-3-(8-propanoyl-3,8-diazabicyclo[3.2.1]octan-3-yl)propylidene]amino] N-(4-methoxyphenyl)carbamate hydrochloride
MOLECULAR FORMULA: C26H33ClN4O4
MOLECULAR WEIGHT: 501.01762
SMILES: CCC(=O)N1C2CCC1CN(C2)C(C/C=N/OC(=O)NC3=CC=C(C=C3)OC)C4=CC=CC=C4.Cl
Structure:
CAS RN: 97670-11-6
CAS Name: N-(4-methoxyphenyl)carbamic acid [(E)-[3-[8-[(2-nitrophenyl)-oxomethyl]-3,8-diazabicyclo[3.2.1]octan-3-yl]-3-phenylpropylidene]amino] ester hydrochloride
OPENEYE Name: [(E)-[3-[8-(2-nitrobenzoyl)-3,8-diazabicyclo[3.2.1]octan-3-yl]-3-phenyl-propylidene]amino] N-(4-methoxyphenyl)carbamate hydrochloride
IUPAC Name: [(E)-[3-[8-(2-nitrobenzoyl)-3,8-diazabicyclo[3.2.1]octan-3-yl]-3-phenylpropylidene]amino] N-(4-methoxyphenyl)carbamate hydrochloride
SYSTEMATIC NAME: [(E)-[3-[8-(2-nitrophenyl)carbonyl-3,8-diazabicyclo[3.2.1]octan-3-yl]-3-phenyl-propylidene]amino] N-(4-methoxyphenyl)carbamate hydrochloride
MOLECULAR FORMULA: C30H32ClN5O6
MOLECULAR WEIGHT: 594.05798
SMILES: COC1=CC=C(C=C1)NC(=O)O/N=C/CC(C2=CC=CC=C2)N3CC4CCC(C3)N4C(=O)C5=CC=CC=C5[N+](=O)[O-].Cl
Structure:
CAS RN: 97670-18-3
CAS Name: N-(4-methoxyphenyl)carbamic acid [(Z)-[4,7,7-trimethyl-2-[[8-(1-oxopropyl)-3,8-diazabicyclo[3.2.1]octan-3-yl]methyl]-3-bicyclo[2.2.1]heptanylidene]amino] ester hydrochloride
OPENEYE Name: [(Z)-[1,7,7-trimethyl-3-[(8-propanoyl-3,8-diazabicyclo[3.2.1]octan-3-yl)methyl]norbornan-2-ylidene]amino] N-(4-methoxyphenyl)carbamate hydrochloride
IUPAC Name: [(Z)-[4,7,7-trimethyl-2-[(8-propanoyl-3,8-diazabicyclo[3.2.1]octan-3-yl)methyl]-3-bicyclo[2.2.1]heptanylidene]amino] N-(4-methoxyphenyl)carbamate hydrochloride
SYSTEMATIC NAME: [(Z)-[4,7,7-trimethyl-2-[(8-propanoyl-3,8-diazabicyclo[3.2.1]octan-3-yl)methyl]-3-bicyclo[2.2.1]heptanylidene]amino] N-(4-methoxyphenyl)carbamate hydrochloride
MOLECULAR FORMULA: C28H41ClN4O4
MOLECULAR WEIGHT: 533.10254
SMILES: CCC(=O)N1C2CCC1CN(C2)CC\3C4CCC(/C3=N\OC(=O)NC5=CC=C(C=C5)OC)(C4(C)C)C.Cl
Structure:
CAS RN: 97290-45-4
CAS Name: (2R)-2-acetamido-3-[[2-[2,4-dibromo-6-[[cyclohexyl(methyl)amino]methyl]anilino]-2-oxoethyl]thio]propanoic acid methyl ester
OPENEYE Name: methyl (2R)-2-acetamido-3-[2-[2,4-dibromo-6-[[cyclohexyl(methyl)amino]methyl]anilino]-2-oxo-ethyl]sulfanyl-propanoate
IUPAC Name: methyl (2R)-2-acetamido-3-[2-[2,4-dibromo-6-[[cyclohexyl(methyl)amino]methyl]anilino]-2-oxoethyl]sulfanylpropanoate
SYSTEMATIC NAME: methyl (2R)-2-acetamido-3-[2-[[2,4-bis(bromanyl)-6-[[cyclohexyl(methyl)amino]methyl]phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-propanoate
MOLECULAR FORMULA: C22H31Br2N3O4S
MOLECULAR WEIGHT: 593.37224
SMILES: CC(=O)N[C@@H](CSCC(=O)NC1=C(C=C(C=C1CN(C)C2CCCCC2)Br)Br)C(=O)OC
Structure:
CAS RN: 104775-21-5
CAS Name: (1R,2R)-2-[[[(Z)-(3-chloro-5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-(4-chlorophenyl)methyl]amino]methyl]-1-cyclopropanecarboxylic acid ethyl ester
OPENEYE Name: ethyl (1R,2R)-2-[[[(Z)-(3-chloro-5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]methyl]cyclopropanecarboxylate
IUPAC Name: ethyl (1R,2R)-2-[[[(Z)-(3-chloro-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]methyl]cyclopropane-1-carboxylate
SYSTEMATIC NAME: ethyl (1R,2R)-2-[[[(Z)-(3-chloranyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]methyl]cyclopropane-1-carboxylate
MOLECULAR FORMULA: C21H21Cl2NO3
MOLECULAR WEIGHT: 406.30234
SMILES: CCOC(=O)[C@@H]1C[C@H]1CN/C(=C\2/C=C(C=C(C2=O)C)Cl)/C3=CC=C(C=C3)Cl
Structure:
CAS RN: 104775-20-4
CAS Name: (1R,2S)-2-[[[(Z)-(3-chloro-5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-(4-chlorophenyl)methyl]amino]methyl]-1-cyclopropanecarboxylic acid ethyl ester
OPENEYE Name: ethyl (1R,2S)-2-[[[(Z)-(3-chloro-5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]methyl]cyclopropanecarboxylate
IUPAC Name: ethyl (1R,2S)-2-[[[(Z)-(3-chloro-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]methyl]cyclopropane-1-carboxylate
SYSTEMATIC NAME: ethyl (1R,2S)-2-[[[(Z)-(3-chloranyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]methyl]cyclopropane-1-carboxylate
MOLECULAR FORMULA: C21H21Cl2NO3
MOLECULAR WEIGHT: 406.30234
SMILES: CCOC(=O)[C@@H]1C[C@@H]1CN/C(=C\2/C=C(C=C(C2=O)C)Cl)/C3=CC=C(C=C3)Cl
Structure:
CAS RN: 104775-19-1
CAS Name: 2-[1-[[[(Z)-(3-chloro-5-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)-(4-chlorophenyl)methyl]amino]methyl]cyclopropyl]acetic acid
OPENEYE Name: 2-[1-[[[(Z)-(3-chloro-5-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]methyl]cyclopropyl]acetic acid
IUPAC Name: 2-[1-[[[(Z)-(3-chloro-5-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]methyl]cyclopropyl]acetic acid
SYSTEMATIC NAME: 2-[1-[[[(Z)-(3-chloranyl-5-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-(4-chlorophenyl)methyl]amino]methyl]cyclopropyl]ethanoic acid
MOLECULAR FORMULA: C20H19Cl2NO3
MOLECULAR WEIGHT: 392.27576
SMILES: CC1=CC(=C/C(=C(\C2=CC=C(C=C2)Cl)/NCC3(CC3)CC(=O)O)/C1=O)Cl
Structure:
CAS RN: 102571-08-4
CAS Name: 2-(1-cyclopentenyl)-2-hydroxy-3-pentynoic acid 1-azabicyclo[2.2.2]octan-3-yl ester
OPENEYE Name: quinuclidin-3-yl 2-(cyclopenten-1-yl)-2-hydroxy-pent-3-ynoate
IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 2-(cyclopenten-1-yl)-2-hydroxypent-3-ynoate
SYSTEMATIC NAME: 1-azabicyclo[2.2.2]octan-3-yl 2-(cyclopenten-1-yl)-2-oxidanyl-pent-3-ynoate
MOLECULAR FORMULA: C17H23NO3
MOLECULAR WEIGHT: 289.36942
SMILES: CC#CC(C1=CCCC1)(C(=O)OC2CN3CCC2CC3)O
Structure:
CAS RN: 102571-05-1
CAS Name: 2,2,3-trifluoro-4,5,6,6a-tetrahydrocyclopenta[b]thiophene
OPENEYE Name: 2,2,3-trifluoro-4,5,6,6a-tetrahydrocyclopenta[b]thiophene
IUPAC Name: 2,2,3-trifluoro-4,5,6,6a-tetrahydrocyclopenta[b]thiophene
SYSTEMATIC NAME: 2,2,3-tris(fluoranyl)-4,5,6,6a-tetrahydrocyclopenta[b]thiophene
MOLECULAR FORMULA: C7H7F3S
MOLECULAR WEIGHT: 180.19069
SMILES: C1CC2C(=C(C(S2)(F)F)F)C1
Structure:
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