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

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 4-[3-cyclohexylsulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: [2-(4-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-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-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-(4-methoxyphenyl)ethyl] ester Formula: C26H27NO6S MolecularWeight: 481.56068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)CC(C3=O)SC4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)N3C(=O)CC(C3=O)SC4CCCCC4

InChI

InChI=1S/C26H27NO6S/c1-32-20-13-9-17(10-14-20)22(28)16-33-26(31)18-7-11-19(12-8-18)27-24(29)15-23(25(27)30)34-21-5-3-2-4-6-21/h7-14,21,23H,2-6,15-16H2,1H3