(2-nitrophenyl)methyl 4-[[(4-methylphenyl)amino]methyl]benzoate

Systemtic Name: (2-nitrophenyl)methyl 4-[[(4-methylphenyl)amino]methyl]benzoate Openeye Name: (2-nitrophenyl)methyl 4-[(4-methylanilino)methyl]benzoate CAS Name: 4-[(4-methylanilino)methyl]benzoic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 4-[(4-methylanilino)methyl]benzoate Traditional Name: 4-(p-toluidinomethyl)benzoic acid (2-nitrobenzyl) ester Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NCC2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O4/c1-16-6-12-20(13-7-16)23-14-17-8-10-18(11-9-17)22(25)28-15-19-4-2-3-5-21(19)24(26)27/h2-13,23H,14-15H2,1H3