[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoate

Systemtic Name: [2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoate Openeye Name: [2-(4-cyclohexylphenyl)-2-oxo-ethyl] 2-(1,3-dioxoisoindolin-2-yl)-4-methyl-pentanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-methylpentanoic acid [2-(4-cyclohexylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-cyclohexylphenyl)-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoate Traditional Name: 4-methyl-2-phthalimido-valeric acid [2-(4-cyclohexylphenyl)-2-keto-ethyl] ester Formula: C28H31NO5 MolecularWeight: 461.54944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC(=O)C1=CC=C(C=C1)C2CCCCC2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)CC(C(=O)OCC(=O)C1=CC=C(C=C1)C2CCCCC2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C28H31NO5/c1-18(2)16-24(29-26(31)22-10-6-7-11-23(22)27(29)32)28(33)34-17-25(30)21-14-12-20(13-15-21)19-8-4-3-5-9-19/h6-7,10-15,18-19,24H,3-5,8-9,16-17H2,1-2H3