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

Systemtic Name: (4-nitrophenyl)methyl 3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]benzoate Openeye Name: (4-nitrophenyl)methyl 3-[(1,3-dioxoisoindolin-2-yl)methyl]benzoate CAS Name: 3-[(1,3-dioxo-2-isoindolyl)methyl]benzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-[(1,3-dioxoisoindol-2-yl)methyl]benzoate Traditional Name: 3-(phthalimidomethyl)benzoic acid (4-nitrobenzyl) ester Formula: C23H16N2O6 MolecularWeight: 416.38294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CC=CC(=C3)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CC=CC(=C3)C(=O)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H16N2O6/c26-21-19-6-1-2-7-20(19)22(27)24(21)13-16-4-3-5-17(12-16)23(28)31-14-15-8-10-18(11-9-15)25(29)30/h1-12H,13-14H2