[2-(2-methoxyphenyl)-2-oxidanylidene-ethyl] 4-[3-cyclohexylsulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: [2-(2-methoxyphenyl)-2-oxidanylidene-ethyl] 4-[3-cyclohexylsulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: [2-(2-methoxyphenyl)-2-oxo-ethyl] 4-(3-cyclohexylsulfanyl-2,5-dioxo-pyrrolidin-1-yl)benzoate CAS Name: 4-[3-(cyclohexylthio)-2,5-dioxo-1-pyrrolidinyl]benzoic acid [2-(2-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyphenyl)-2-oxoethyl] 4-(3-cyclohexylsulfanyl-2,5-dioxopyrrolidin-1-yl)benzoate Traditional Name: 4-[3-(cyclohexylthio)-2,5-diketo-pyrrolidino]benzoic acid [2-keto-2-(2-methoxyphenyl)ethyl] ester Formula: C26H27NO6S MolecularWeight: 481.56068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)CC(C3=O)SC4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)CC(C3=O)SC4CCCCC4

InChI

InChI=1S/C26H27NO6S/c1-32-22-10-6-5-9-20(22)21(28)16-33-26(31)17-11-13-18(14-12-17)27-24(29)15-23(25(27)30)34-19-7-3-2-4-8-19/h5-6,9-14,19,23H,2-4,7-8,15-16H2,1H3