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

Systemtic Name: (2-cyanophenyl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (2-cyanophenyl)methyl 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid (2-cyanobenzyl) ester Formula: C20H16N2O4 MolecularWeight: 348.35204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)C#N

InChI

InChI=1S/C20H16N2O4/c21-12-14-6-1-2-7-15(14)13-26-18(23)10-5-11-22-19(24)16-8-3-4-9-17(16)20(22)25/h1-4,6-9H,5,10-11,13H2