[3-[(2-methylphenyl)iminomethyl]phenyl] 3,5-dinitrobenzoate

Systemtic Name: [3-[(2-methylphenyl)iminomethyl]phenyl] 3,5-dinitrobenzoate Openeye Name: [3-(o-tolyliminomethyl)phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [3-[(2-methylphenyl)iminomethyl]phenyl] ester IUPAC Name: [3-[(2-methylphenyl)iminomethyl]phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [3-(o-tolyliminomethyl)phenyl] ester Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N=CC2=CC(=CC=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N=CC2=CC(=CC=C2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O6/c1-14-5-2-3-8-20(14)22-13-15-6-4-7-19(9-15)30-21(25)16-10-17(23(26)27)12-18(11-16)24(28)29/h2-13H,1H3