(phenylmethyl) 7-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanylidene-heptanoate

Systemtic Name: (phenylmethyl) 7-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-oxidanylidene-heptanoate Openeye Name: benzyl 7-(1,3-dioxoisoindolin-2-yl)-2-oxo-heptanoate CAS Name: 7-(1,3-dioxo-2-isoindolyl)-2-oxoheptanoic acid (phenylmethyl) ester IUPAC Name: benzyl 7-(1,3-dioxoisoindol-2-yl)-2-oxoheptanoate Traditional Name: 2-keto-7-phthalimido-enanthic acid benzyl ester Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C22H21NO5/c24-19(22(27)28-15-16-9-3-1-4-10-16)13-5-2-8-14-23-20(25)17-11-6-7-12-18(17)21(23)26/h1,3-4,6-7,9-12H,2,5,8,13-15H2