[4-[(4-methylphenyl)iminomethyl]-2-nitro-phenyl] 3-methylbenzoate

Systemtic Name: [4-[(4-methylphenyl)iminomethyl]-2-nitro-phenyl] 3-methylbenzoate Openeye Name: [2-nitro-4-(p-tolyliminomethyl)phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-[(4-methylphenyl)iminomethyl]-2-nitrophenyl] ester IUPAC Name: [4-[(4-methylphenyl)iminomethyl]-2-nitrophenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-nitro-4-(p-tolyliminomethyl)phenyl] ester Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=CC2=CC(=C(C=C2)OC(=O)C3=CC(=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N=CC2=CC(=C(C=C2)OC(=O)C3=CC(=CC=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C22H18N2O4/c1-15-6-9-19(10-7-15)23-14-17-8-11-21(20(13-17)24(26)27)28-22(25)18-5-3-4-16(2)12-18/h3-14H,1-2H3