hexadecyl 2-(4-methylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: hexadecyl 2-(4-methylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: hexadecyl 1,3-dioxo-2-(p-tolyl)isoindoline-5-carboxylate CAS Name: 2-(4-methylphenyl)-1,3-dioxo-5-isoindolecarboxylic acid hexadecyl ester IUPAC Name: hexadecyl 2-(4-methylphenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(p-tolyl)isoindoline-5-carboxylic acid cetyl ester Formula: C32H43NO4 MolecularWeight: 505.68812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C32H43NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-37-32(36)26-19-22-28-29(24-26)31(35)33(30(28)34)27-20-17-25(2)18-21-27/h17-22,24H,3-16,23H2,1-2H3