(phenylmethyl) 4-(methylamino)-3-nitro-benzoate

Systemtic Name: (phenylmethyl) 4-(methylamino)-3-nitro-benzoate Openeye Name: benzyl 4-(methylamino)-3-nitro-benzoate CAS Name: 4-(methylamino)-3-nitrobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(methylamino)-3-nitrobenzoate Traditional Name: 4-(methylamino)-3-nitro-benzoic acid benzyl ester Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O4/c1-16-13-8-7-12(9-14(13)17(19)20)15(18)21-10-11-5-3-2-4-6-11/h2-9,16H,10H2,1H3