[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl] heptanoate

Systemtic Name: [4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl] heptanoate Openeye Name: [4-(1,3-dioxoisoindolin-2-yl)phenyl] heptanoate CAS Name: heptanoic acid [4-(1,3-dioxo-2-isoindolyl)phenyl] ester IUPAC Name: [4-(1,3-dioxoisoindol-2-yl)phenyl] heptanoate Traditional Name: enanthic acid (4-phthalimidophenyl) ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCCCC(=O)OC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21NO4/c1-2-3-4-5-10-19(23)26-16-13-11-15(12-14-16)22-20(24)17-8-6-7-9-18(17)21(22)25/h6-9,11-14H,2-5,10H2,1H3