[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 4-[1,3-bis(oxidanylidene)isoindol-2-yl]cyclohexane-1-carboxylate

Systemtic Name: [1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 4-[1,3-bis(oxidanylidene)isoindol-2-yl]cyclohexane-1-carboxylate Openeye Name: [1-methyl-2-oxo-2-(p-tolyl)ethyl] 4-(1,3-dioxoisoindolin-2-yl)cyclohexanecarboxylate CAS Name: 4-(1,3-dioxo-2-isoindolyl)-1-cyclohexanecarboxylic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylphenyl)-1-oxopropan-2-yl] 4-(1,3-dioxoisoindol-2-yl)cyclohexane-1-carboxylate Traditional Name: 4-phthalimidocyclohexanecarboxylic acid [2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C25H25NO5 MolecularWeight: 419.4697

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2CCC(CC2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2CCC(CC2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H25NO5/c1-15-7-9-17(10-8-15)22(27)16(2)31-25(30)18-11-13-19(14-12-18)26-23(28)20-5-3-4-6-21(20)24(26)29/h3-10,16,18-19H,11-14H2,1-2H3