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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

InChI

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