(4-methoxy-2-nitro-phenyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: (4-methoxy-2-nitro-phenyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (4-methoxy-2-nitro-phenyl) 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid (4-methoxy-2-nitrophenyl) ester IUPAC Name: (4-methoxy-2-nitrophenyl) 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid (4-methoxy-2-nitro-phenyl) ester Formula: C19H16N2O7 MolecularWeight: 384.33954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O7/c1-27-12-8-9-16(15(11-12)21(25)26)28-17(22)7-4-10-20-18(23)13-5-2-3-6-14(13)19(20)24/h2-3,5-6,8-9,11H,4,7,10H2,1H3