propyl 4-[5-(3-nitrophenyl)carbonyl-1,3-bis(oxidanylidene)isoindol-2-yl]benzoate

Systemtic Name: propyl 4-[5-(3-nitrophenyl)carbonyl-1,3-bis(oxidanylidene)isoindol-2-yl]benzoate Openeye Name: propyl 4-[5-(3-nitrobenzoyl)-1,3-dioxo-isoindolin-2-yl]benzoate CAS Name: 4-[5-[(3-nitrophenyl)-oxomethyl]-1,3-dioxo-2-isoindolyl]benzoic acid propyl ester IUPAC Name: propyl 4-[5-(3-nitrobenzoyl)-1,3-dioxoisoindol-2-yl]benzoate Traditional Name: 4-[1,3-diketo-5-(3-nitrobenzoyl)isoindolin-2-yl]benzoic acid propyl ester Formula: C25H18N2O7 MolecularWeight: 458.41962

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H18N2O7/c1-2-12-34-25(31)15-6-9-18(10-7-15)26-23(29)20-11-8-17(14-21(20)24(26)30)22(28)16-4-3-5-19(13-16)27(32)33/h3-11,13-14H,2,12H2,1H3