methyl 4-nitro-3-[(phenylmethyl)iminomethyl]benzoate

Systemtic Name: methyl 4-nitro-3-[(phenylmethyl)iminomethyl]benzoate Openeye Name: methyl 3-(benzyliminomethyl)-4-nitro-benzoate CAS Name: 4-nitro-3-[(phenylmethyl)iminomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-(benzyliminomethyl)-4-nitrobenzoate Traditional Name: 3-(benzyliminomethyl)-4-nitro-benzoic acid methyl ester Formula: C16H14N2O4 MolecularWeight: 298.29336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])C=NCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])C=NCC2=CC=CC=C2

InChI

InChI=1S/C16H14N2O4/c1-22-16(19)13-7-8-15(18(20)21)14(9-13)11-17-10-12-5-3-2-4-6-12/h2-9,11H,10H2,1H3