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

Systemtic Name: (4-nitrophenyl)methyl 4-[[(4-methylphenyl)amino]methyl]benzoate Openeye Name: (4-nitrophenyl)methyl 4-[(4-methylanilino)methyl]benzoate CAS Name: 4-[(4-methylanilino)methyl]benzoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 4-[(4-methylanilino)methyl]benzoate Traditional Name: 4-(p-toluidinomethyl)benzoic acid (4-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=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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