methyl 4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propoxy]-3-nitro-benzoate Openeye Name: methyl 4-[3-(1,3-dioxoisoindolin-2-yl)propoxy]-3-nitro-benzoate CAS Name: 4-[3-(1,3-dioxo-2-isoindolyl)propoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[3-(1,3-dioxoisoindol-2-yl)propoxy]-3-nitrobenzoate Traditional Name: 3-nitro-4-(3-phthalimidopropoxy)benzoic acid methyl ester Formula: C19H16N2O7 MolecularWeight: 384.33954

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)OCCCN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)OCCCN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]

InChI

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