(4-propylphenyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: (4-propylphenyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (4-propylphenyl) 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid (4-propylphenyl) ester IUPAC Name: (4-propylphenyl) 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid (4-propylphenyl) ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCC1=CC=C(C=C1)OC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21NO4/c1-2-6-15-10-12-16(13-11-15)26-19(23)9-5-14-22-20(24)17-7-3-4-8-18(17)21(22)25/h3-4,7-8,10-13H,2,5-6,9,14H2,1H3