(phenylmethyl) 2-[4-(methylamino)-3-nitro-phenyl]carbonylbenzoate

Systemtic Name: (phenylmethyl) 2-[4-(methylamino)-3-nitro-phenyl]carbonylbenzoate Openeye Name: benzyl 2-[4-(methylamino)-3-nitro-benzoyl]benzoate CAS Name: 2-[[4-(methylamino)-3-nitrophenyl]-oxomethyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[4-(methylamino)-3-nitrobenzoyl]benzoate Traditional Name: 2-[4-(methylamino)-3-nitro-benzoyl]benzoic acid benzyl ester Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H18N2O5/c1-23-19-12-11-16(13-20(19)24(27)28)21(25)17-9-5-6-10-18(17)22(26)29-14-15-7-3-2-4-8-15/h2-13,23H,14H2,1H3