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

Systemtic Name: (5-methyl-2-nitro-phenyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (5-methyl-2-nitro-phenyl) 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid (5-methyl-2-nitrophenyl) ester IUPAC Name: (5-methyl-2-nitrophenyl) 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid (5-methyl-2-nitro-phenyl) ester Formula: C19H16N2O6 MolecularWeight: 368.34014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H16N2O6/c1-12-8-9-15(21(25)26)16(11-12)27-17(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