CAS RN: 113189-05-2
CAS Name: (2R,8S)-8-chloro-4-hydroxy-7-methyl-1-oxo-6-[oxo-(5,6,7-trimethoxy-1H-indol-2-yl)methyl]-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylic acid methyl ester
OPENEYE Name: methyl (2R,8S)-8-chloro-4-hydroxy-7-methyl-1-oxo-6-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylate
IUPAC Name: methyl (2R,8S)-8-chloro-4-hydroxy-7-methyl-1-oxo-6-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylate
SYSTEMATIC NAME: methyl (2R,8S)-8-chloranyl-7-methyl-4-oxidanyl-1-oxidanylidene-6-[(5,6,7-trimethoxy-1H-indol-2-yl)carbonyl]-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylate
MOLECULAR FORMULA: C26H26ClN3O8
MOLECULAR WEIGHT: 543.95294
SMILES: CC1[C@H](CC2=C3C(=O)[C@@H](NC3=C(C=C2N1C(=O)C4=CC5=CC(=C(C(=C5N4)OC)OC)OC)O)C(=O)OC)Cl
Structure:
CAS RN: 118292-35-6
CAS Name: (2R,8S)-8-chloro-4-hydroxy-7-methyl-1-oxo-6-[oxo-(5,6,7-trimethoxy-1H-indol-2-yl)methyl]-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylic acid methyl ester
OPENEYE Name: methyl (2R,8S)-8-chloro-4-hydroxy-7-methyl-1-oxo-6-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylate
IUPAC Name: methyl (2R,8S)-8-chloro-4-hydroxy-7-methyl-1-oxo-6-(5,6,7-trimethoxy-1H-indole-2-carbonyl)-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylate
SYSTEMATIC NAME: methyl (2R,8S)-8-chloranyl-7-methyl-4-oxidanyl-1-oxidanylidene-6-[(5,6,7-trimethoxy-1H-indol-2-yl)carbonyl]-3,7,8,9-tetrahydro-2H-pyrrolo[3,2-f]quinoline-2-carboxylate
MOLECULAR FORMULA: C26H26ClN3O8
MOLECULAR WEIGHT: 543.95294
SMILES: CC1[C@H](CC2=C3C(=O)[C@@H](NC3=C(C=C2N1C(=O)C4=CC5=CC(=C(C(=C5N4)OC)OC)OC)O)C(=O)OC)Cl
Structure:
CAS RN: 112972-60-8
CAS Name: 1,12-dihydroxy-1,6,12,17-tetrazacyclodocosane-2,5,13,16-tetrone
OPENEYE Name: 1,12-dihydroxy-1,6,12,17-tetrazacyclodocosane-2,5,13,16-tetrone
IUPAC Name: 1,12-dihydroxy-1,6,12,17-tetrazacyclodocosane-2,5,13,16-tetrone
SYSTEMATIC NAME: 1,12-bis(oxidanyl)-1,6,12,17-tetrazacyclodocosane-2,5,13,16-tetrone
MOLECULAR FORMULA: C18H32N4O6
MOLECULAR WEIGHT: 400.46988
SMILES: C1CCNC(=O)CCC(=O)N(CCCCCNC(=O)CCC(=O)N(CC1)O)O
Structure:
CAS RN: 112971-92-3
CAS Name: 1,1-dicyclohexyl-2-(1-piperidinyl)ethanol
OPENEYE Name: 1,1-dicyclohexyl-2-(1-piperidyl)ethanol
IUPAC Name: 1,1-dicyclohexyl-2-piperidin-1-ylethanol
SYSTEMATIC NAME: 1,1-dicyclohexyl-2-piperidin-1-yl-ethanol
MOLECULAR FORMULA: C19H35NO
MOLECULAR WEIGHT: 293.4873
SMILES: C1CCC(CC1)C(CN2CCCCC2)(C3CCCCC3)O
Structure:
CAS RN: 112959-07-6
CAS Name: 8-chloro-5-(4-chlorophenyl)-5H-indeno[1,2-d]pyrimidine
OPENEYE Name: 8-chloro-5-(4-chlorophenyl)-5H-indeno[1,2-d]pyrimidine
IUPAC Name: 8-chloro-5-(4-chlorophenyl)-5H-indeno[1,2-d]pyrimidine
SYSTEMATIC NAME: 8-chloranyl-5-(4-chlorophenyl)-5H-indeno[1,2-d]pyrimidine
MOLECULAR FORMULA: C17H10Cl2N2
MOLECULAR WEIGHT: 313.1807
SMILES: C1=CC(=CC=C1C2C3=C(C=C(C=C3)Cl)C4=NC=NC=C24)Cl
Structure:
CAS RN: 112923-53-2
CAS Name: (2S,3R)-4-methylene-5-oxo-2-pentyl-3-oxolanecarboxylic acid
OPENEYE Name: (2S,3R)-4-methylene-5-oxo-2-pentyl-tetrahydrofuran-3-carboxylic acid
IUPAC Name: (2S,3R)-4-methylidene-5-oxo-2-pentyloxolane-3-carboxylic acid
SYSTEMATIC NAME: (2S,3R)-4-methylidene-5-oxidanylidene-2-pentyl-oxolane-3-carboxylic acid
MOLECULAR FORMULA: C11H16O4
MOLECULAR WEIGHT: 212.24234
SMILES: CCCCC[C@H]1[C@@H](C(=C)C(=O)O1)C(=O)O
Structure:
CAS RN: 156680-74-9
CAS Name: (8R,9S,10R,13S,14S,16R)-16-fluoro-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
OPENEYE Name: (8R,9S,10R,13S,14S,16R)-16-fluoro-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
IUPAC Name: (8R,9S,10R,13S,14S,16R)-16-fluoro-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
SYSTEMATIC NAME: (8R,9S,10R,13S,14S,16R)-16-fluoranyl-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
MOLECULAR FORMULA: C19H27FO
MOLECULAR WEIGHT: 290.415483
SMILES: C[C@]12CCCCC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3C[C@H](C4=O)F)C
Structure:
CAS RN: 112859-71-9
CAS Name: (8R,9S,10R,13S,14S,16R)-16-fluoro-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
OPENEYE Name: (8R,9S,10R,13S,14S,16R)-16-fluoro-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
IUPAC Name: (8R,9S,10R,13S,14S,16R)-16-fluoro-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
SYSTEMATIC NAME: (8R,9S,10R,13S,14S,16R)-16-fluoranyl-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
MOLECULAR FORMULA: C19H27FO
MOLECULAR WEIGHT: 290.415483
SMILES: C[C@]12CCCCC1=CC[C@@H]3[C@@H]2CC[C@]4([C@H]3C[C@H](C4=O)F)C
Structure:
CAS RN: 112808-99-8
CAS Name: butanedioic acid; 4-[(4-cyanophenyl)-(1-imidazolyl)methyl]benzonitrile
OPENEYE Name: 4-[(4-cyanophenyl)-imidazol-1-yl-methyl]benzonitrile; succinic acid
IUPAC Name: butanedioic acid; 4-[(4-cyanophenyl)-imidazol-1-ylmethyl]benzonitrile
SYSTEMATIC NAME: butanedioic acid; 4-[(4-cyanophenyl)-imidazol-1-yl-methyl]benzenecarbonitrile
MOLECULAR FORMULA: C40H30N8O4
MOLECULAR WEIGHT: 686.7174
SMILES: C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)N3C=CN=C3.C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)N3C=CN=C3.C(CC(=O)O)C(=O)O
Structure:
CAS RN: 81560-40-9
CAS Name: 1H-imidazole; 2-oxopentanedioic acid
OPENEYE Name: imidazole; 2-oxopentanedioic acid
IUPAC Name: 1H-imidazole; 2-oxopentanedioic acid
SYSTEMATIC NAME: 1H-imidazole; 2-oxidanylidenepentanedioic acid
MOLECULAR FORMULA: C8H10N2O5
MOLECULAR WEIGHT: 214.1754
SMILES: C1=CN=CN1.C(CC(=O)O)C(=O)C(=O)O
Structure:
CAS RN: 874-73-7
CAS Name: [(1R,2S)-2-acetyloxycyclobutyl]-trimethylammonium iodide
OPENEYE Name: [(1R,2S)-2-acetoxycyclobutyl]-trimethyl-ammonium iodide
IUPAC Name: [(1R,2S)-2-acetyloxycyclobutyl]-trimethylazanium iodide
SYSTEMATIC NAME: [(1R,2S)-2-acetyloxycyclobutyl]-trimethyl-azanium iodide
MOLECULAR FORMULA: C9H18INO2
MOLECULAR WEIGHT: 299.14919
SMILES: CC(=O)O[C@H]1CC[C@H]1[N+](C)(C)C.[I-]
Structure:
CAS RN: 87453-63-2
CAS Name: N,N-bis(2-chloroethyl)-3-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethyl-4-piperidinyl)-2-oxo-1,3,2$l^{5}-oxazaphosphorinan-2-amine
OPENEYE Name: N,N-bis(2-chloroethyl)-3-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethyl-4-piperidyl)-2-oxo-1,3,2$l^{5}-oxazaphosphinan-2-amine
IUPAC Name: N,N-bis(2-chloroethyl)-3-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethylpiperidin-4-yl)-2-oxo-1,3,2$l^{5}-oxazaphosphinan-2-amine
SYSTEMATIC NAME: N,N-bis(2-chloroethyl)-3-(1-$l^{1}-oxidanyl-2,2,6,6-tetramethyl-piperidin-4-yl)-2-oxidanylidene-1,3,2$l^{5}-oxazaphosphinan-2-amine
MOLECULAR FORMULA: C16H31Cl2N3O3P
MOLECULAR WEIGHT: 415.315401
SMILES: CC1(CC(CC(N1[O])(C)C)N2CCCOP2(=O)N(CCCl)CCCl)C
Structure:
CAS RN: 87399-97-1
CAS Name: 1-nitro-4-[(sulfoseleno)methyl]benzene
OPENEYE Name: 1-nitro-4-(sulfoselanylmethyl)benzene
IUPAC Name: 1-nitro-4-(sulfoselanylmethyl)benzene
SYSTEMATIC NAME: 1-nitro-4-(sulfoselanylmethyl)benzene
MOLECULAR FORMULA: C7H7NO5SSe
MOLECULAR WEIGHT: 296.15918
SMILES: C1=CC(=CC=C1C[Se]S(=O)(=O)O)[N+](=O)[O-]
Structure:
CAS RN: 87397-89-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C16H18N2O
MOLECULAR WEIGHT: 254.32692
SMILES: C[C@@]12CN([C@@H]3CC4=CNC5=CC=CC(=C45)[C@@H]3[C@@H]1O2)C
Structure:
CAS RN: 87299-25-0
CAS Name: 1,1-diethoxy-3-(1-naphthalenyloxy)-2-propanol
OPENEYE Name: 1,1-diethoxy-3-(1-naphthyloxy)propan-2-ol
IUPAC Name: 1,1-diethoxy-3-naphthalen-1-yloxypropan-2-ol
SYSTEMATIC NAME: 1,1-diethoxy-3-naphthalen-1-yloxy-propan-2-ol
MOLECULAR FORMULA: C17H22O4
MOLECULAR WEIGHT: 290.35418
SMILES: CCOC(C(COC1=CC=CC2=CC=CC=C21)O)OCC
Structure:
CAS RN: 82510-13-2
CAS Name: 3-[2-[[3-[(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)amino]-1-oxopropyl]amino]ethylthio]-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
OPENEYE Name: 3-[2-[3-[(2,4-dihydroxy-3,3-dimethyl-butanoyl)amino]propanoylamino]ethylsulfanyl]-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
IUPAC Name: 3-[2-[3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoylamino]ethylsulfanyl]-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
SYSTEMATIC NAME: 3-[2-[3-[[3,3-dimethyl-2,4-bis(oxidanyl)butanoyl]amino]propanoylamino]ethylsulfanyl]-6-(1-hydroxyethyl)-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
MOLECULAR FORMULA: C20H31N3O8S
MOLECULAR WEIGHT: 473.54044
SMILES: CC(C1C2CC(=C(N2C1=O)C(=O)O)SCCNC(=O)CCNC(=O)C(C(C)(C)CO)O)O
Structure:
CAS RN: 36338-04-2
CAS Name: N-acetyl-N-(4-benzo[a]pyrenyl)acetamide
OPENEYE Name: N-acetyl-N-benzo[a]pyren-4-yl-acetamide
IUPAC Name: N-acetyl-N-benzo[a]pyren-4-ylacetamide
SYSTEMATIC NAME: N-benzo[a]pyren-4-yl-N-ethanoyl-ethanamide
MOLECULAR FORMULA: C24H17NO2
MOLECULAR WEIGHT: 351.39728
SMILES: CC(=O)N(C1=CC2=CC3=CC=CC=C3C4=C2C5=C(C=CC=C15)C=C4)C(=O)C
Structure:
CAS RN: 118421-49-1
CAS Name: 4-phenylmethoxybenzoic acid [3-(1,3-dimethyl-2,6-dioxo-7-purinyl)-2-hydroxypropyl] ester
OPENEYE Name: [3-(1,3-dimethyl-2,6-dioxo-purin-7-yl)-2-hydroxy-propyl] 4-benzyloxybenzoate
IUPAC Name: [3-(1,3-dimethyl-2,6-dioxopurin-7-yl)-2-hydroxypropyl] 4-phenylmethoxybenzoate
SYSTEMATIC NAME: [3-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-2-oxidanyl-propyl] 4-phenylmethoxybenzoate
MOLECULAR FORMULA: C24H24N4O6
MOLECULAR WEIGHT: 464.47056
SMILES: CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(COC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)O
Structure:
CAS RN: 87179-46-2
CAS Name: 2-[(4-bromophenyl)methoxy]acetic acid
OPENEYE Name: 2-[(4-bromophenyl)methoxy]acetic acid
IUPAC Name: 2-[(4-bromophenyl)methoxy]acetic acid
SYSTEMATIC NAME: 2-[(4-bromophenyl)methoxy]ethanoic acid
MOLECULAR FORMULA: C9H9BrO3
MOLECULAR WEIGHT: 245.06996
SMILES: C1=CC(=CC=C1COCC(=O)O)Br
Structure:
CAS RN: 87084-66-0
CAS Name: 2-(1-oxobutoxy)propane-1,2,3-tricarboxylic acid trihexyl ester
OPENEYE Name: trihexyl 2-butanoyloxypropane-1,2,3-tricarboxylate
IUPAC Name: trihexyl 2-butanoyloxypropane-1,2,3-tricarboxylate
SYSTEMATIC NAME: trihexyl 2-butanoyloxypropane-1,2,3-tricarboxylate
MOLECULAR FORMULA: C28H50O8
MOLECULAR WEIGHT: 514.6918
SMILES: CCCCCCOC(=O)CC(CC(=O)OCCCCCC)(C(=O)OCCCCCC)OC(=O)CCC
Structure:
CAS RN: 87075-15-8
CAS Name: acetic acid [(3aR,4S,6aR,9S,9aS,9bS)-9-hydroxy-9-methyl-3,6-dimethylene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] ester
OPENEYE Name: [(3aR,4S,6aR,9S,9aS,9bS)-9-hydroxy-9-methyl-3,6-dimethylene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] acetate
IUPAC Name: [(3aR,4S,6aR,9S,9aS,9bS)-9-hydroxy-9-methyl-3,6-dimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] acetate
SYSTEMATIC NAME: [(3aR,4S,6aR,9S,9aS,9bS)-9-methyl-3,6-dimethylidene-9-oxidanyl-2-oxidanylidene-3a,4,5,6a,7,8,9a,9b-octahydroazuleno[4,5-b]furan-4-yl] ethanoate
MOLECULAR FORMULA: C17H22O5
MOLECULAR WEIGHT: 306.35358
SMILES: CC(=O)O[C@H]1CC(=C)[C@@H]2CC[C@]([C@@H]2[C@@H]3[C@@H]1C(=C)C(=O)O3)(C)O
Structure:
CAS RN: 87074-88-2
CAS Name: N,N-bis(2-chloroethyl)carbamic acid [(6aR,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c][1]benzopyran-1-yl] ester
OPENEYE Name: [(6aR,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-yl] N,N-bis(2-chloroethyl)carbamate
IUPAC Name: [(6aR,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-yl] N,N-bis(2-chloroethyl)carbamate
SYSTEMATIC NAME: [(6aR,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromen-1-yl] N,N-bis(2-chloroethyl)carbamate
MOLECULAR FORMULA: C26H37Cl2NO3
MOLECULAR WEIGHT: 482.48288
SMILES: CCCCCC1=CC2=C([C@@H]3C=C(CC[C@H]3C(O2)(C)C)C)C(=C1)OC(=O)N(CCCl)CCCl
Structure:
CAS RN: 82451-61-4
CAS Name: 15-hydroxyeicosa-2,4,6-trienoic acid
OPENEYE Name: 15-hydroxyicosa-2,4,6-trienoic acid
IUPAC Name: 15-hydroxyicosa-2,4,6-trienoic acid
SYSTEMATIC NAME: 15-oxidanylicosa-2,4,6-trienoic acid
MOLECULAR FORMULA: C20H34O3
MOLECULAR WEIGHT: 322.48216
SMILES: CCCCCC(CCCCCCCC=CC=CC=CC(=O)O)O
Structure:
CAS RN: 87046-69-3
CAS Name: 1-[[1-(4-aminophenyl)-2-methylpropan-2-yl]amino]-3-(9H-carbazol-4-yloxy)-2-propanol
OPENEYE Name: 1-[[2-(4-aminophenyl)-1,1-dimethyl-ethyl]amino]-3-(9H-carbazol-4-yloxy)propan-2-ol
IUPAC Name: 1-[[1-(4-aminophenyl)-2-methylpropan-2-yl]amino]-3-(9H-carbazol-4-yloxy)propan-2-ol
SYSTEMATIC NAME: 1-[[1-(4-aminophenyl)-2-methyl-propan-2-yl]amino]-3-(9H-carbazol-4-yloxy)propan-2-ol
MOLECULAR FORMULA: C25H29N3O2
MOLECULAR WEIGHT: 403.51666
SMILES: CC(C)(CC1=CC=C(C=C1)N)NCC(COC2=CC=CC3=C2C4=CC=CC=C4N3)O
Structure:
CAS RN: 82402-81-1
CAS Name: 7-[3-[[3-[(4-ethylphenyl)thio]-2-hydroxypropyl]amino]-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]-5-heptenoic acid
OPENEYE Name: 7-[3-[[3-(4-ethylphenyl)sulfanyl-2-hydroxy-propyl]amino]-6,6-dimethyl-norpinan-2-yl]hept-5-enoic acid
IUPAC Name: 7-[3-[[3-(4-ethylphenyl)sulfanyl-2-hydroxypropyl]amino]-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
SYSTEMATIC NAME: 7-[3-[[3-(4-ethylphenyl)sulfanyl-2-oxidanyl-propyl]amino]-6,6-dimethyl-4-bicyclo[3.1.1]heptanyl]hept-5-enoic acid
MOLECULAR FORMULA: C27H41NO3S
MOLECULAR WEIGHT: 459.68434
SMILES: CCC1=CC=C(C=C1)SCC(CNC2CC3CC(C2CC=CCCCC(=O)O)C3(C)C)O
Structure:
CAS RN: 86999-29-3
CAS Name: 4-[3-(4-carbamimidoylphenoxy)-2,2-bis[(4-carbamimidoylphenoxy)methyl]propoxy]benzenecarboximidamide
OPENEYE Name: 4-[3-(4-carbamimidoylphenoxy)-2,2-bis[(4-carbamimidoylphenoxy)methyl]propoxy]benzamidine
IUPAC Name: 4-[3-(4-carbamimidoylphenoxy)-2,2-bis[(4-carbamimidoylphenoxy)methyl]propoxy]benzenecarboximidamide
SYSTEMATIC NAME: 4-[3-(4-carbamimidoylphenoxy)-2,2-bis[(4-carbamimidoylphenoxy)methyl]propoxy]benzenecarboximidamide
MOLECULAR FORMULA: C33H36N8O4
MOLECULAR WEIGHT: 608.69014
SMILES: C1=CC(=CC=C1C(=N)N)OCC(COC2=CC=C(C=C2)C(=N)N)(COC3=CC=C(C=C3)C(=N)N)COC4=CC=C(C=C4)C(=N)N
Structure:
CAS RN: 86918-67-4
CAS Name: 2-[2-[2-[4-(diphenylmethylene)-1-piperidinyl]ethoxy]ethoxy]acetic acid hydrochloride
OPENEYE Name: 2-[2-[2-(4-benzhydrylidene-1-piperidyl)ethoxy]ethoxy]acetic acid hydrochloride
IUPAC Name: 2-[2-[2-(4-benzhydrylidenepiperidin-1-yl)ethoxy]ethoxy]acetic acid hydrochloride
SYSTEMATIC NAME: 2-[2-[2-[4-(diphenylmethylidene)piperidin-1-yl]ethoxy]ethoxy]ethanoic acid hydrochloride
MOLECULAR FORMULA: C24H30ClNO4
MOLECULAR WEIGHT: 431.9523
SMILES: C1CN(CCC1=C(C2=CC=CC=C2)C3=CC=CC=C3)CCOCCOCC(=O)O.Cl
Structure:
CAS RN: 86883-55-8
CAS Name: 4-[2-[(4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one
OPENEYE Name: 4-[2-[(4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]decalin-1-yl]ethyl]-2H-furan-5-one
IUPAC Name: 4-[2-[(4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one
SYSTEMATIC NAME: 4-[2-[(4aS,5R,6R,8aS)-5-[[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxymethyl]-5,8a-dimethyl-2-methylidene-6-oxidanyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethyl]-2H-furan-5-one
MOLECULAR FORMULA: C26H40O9
MOLECULAR WEIGHT: 496.5904
SMILES: C[C@@]12CC[C@H]([C@@]([C@H]1CCC(=C)C2CCC3=CCOC3=O)(C)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O
Structure:
CAS RN: 82208-84-2
CAS Name: N-phenyl-N-[(3S,4R)-1-(2-phenylethyl)-3-prop-2-enyl-4-piperidinyl]propanamide hydrochloride
OPENEYE Name: N-[(3S,4R)-3-allyl-1-(2-phenylethyl)-4-piperidyl]-N-phenyl-propanamide hydrochloride
IUPAC Name: N-phenyl-N-[(3S,4R)-1-(2-phenylethyl)-3-prop-2-enylpiperidin-4-yl]propanamide hydrochloride
SYSTEMATIC NAME: N-phenyl-N-[(3S,4R)-1-(2-phenylethyl)-3-prop-2-enyl-piperidin-4-yl]propanamide hydrochloride
MOLECULAR FORMULA: C25H33ClN2O
MOLECULAR WEIGHT: 412.99532
SMILES: CCC(=O)N([C@@H]1CCN(C[C@@H]1CC=C)CCC2=CC=CC=C2)C3=CC=CC=C3.Cl
Structure:
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