methyl 4-[[(2-methyl-3-nitro-phenyl)-(phenylmethyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[(2-methyl-3-nitro-phenyl)-(phenylmethyl)amino]methyl]benzoate Openeye Name: methyl 4-[(N-benzyl-2-methyl-3-nitro-anilino)methyl]benzoate CAS Name: 4-[(2-methyl-3-nitro-N-(phenylmethyl)anilino)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(N-benzyl-2-methyl-3-nitroanilino)methyl]benzoate Traditional Name: 4-[(N-benzyl-2-methyl-3-nitro-anilino)methyl]benzoic acid methyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])N(CC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])N(CC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H22N2O4/c1-17-21(9-6-10-22(17)25(27)28)24(15-18-7-4-3-5-8-18)16-19-11-13-20(14-12-19)23(26)29-2/h3-14H,15-16H2,1-2H3