(2-azanyl-2-oxidanylidene-ethyl) 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate Openeye Name: (2-amino-2-oxo-ethyl) 2-[(2-chlorophenyl)methylamino]-5-nitro-benzoate CAS Name: 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-[(2-chlorophenyl)methylamino]-5-nitrobenzoate Traditional Name: 2-[(2-chlorobenzyl)amino]-5-nitro-benzoic acid (2-amino-2-keto-ethyl) ester Formula: C16H14ClN3O5 MolecularWeight: 363.75246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC(=O)N)Cl

InChI

InChI=1S/C16H14ClN3O5/c17-13-4-2-1-3-10(13)8-19-14-6-5-11(20(23)24)7-12(14)16(22)25-9-15(18)21/h1-7,19H,8-9H2,(H2,18,21)