(2-oxidanylidene-2-phenylazanyl-ethyl) 2-(methylamino)-5-nitro-benzoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-(methylamino)-5-nitro-benzoate Openeye Name: (2-anilino-2-oxo-ethyl) 2-(methylamino)-5-nitro-benzoate CAS Name: 2-(methylamino)-5-nitrobenzoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-(methylamino)-5-nitrobenzoate Traditional Name: 2-(methylamino)-5-nitro-benzoic acid (2-anilino-2-keto-ethyl) ester Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=CC=C2

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C16H15N3O5/c1-17-14-8-7-12(19(22)23)9-13(14)16(21)24-10-15(20)18-11-5-3-2-4-6-11/h2-9,17H,10H2,1H3,(H,18,20)