(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-(2-hydroxyethylamino)-5-nitro-benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-(2-hydroxyethylamino)-5-nitro-benzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 2-(2-hydroxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-hydroxyethylamino)-5-nitrobenzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 2-(2-hydroxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-hydroxyethylamino)-5-nitro-benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C17H17N3O6 MolecularWeight: 359.33338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCO

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)N)OC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCO

InChI

InChI=1S/C17H17N3O6/c18-16(22)15(11-4-2-1-3-5-11)26-17(23)13-10-12(20(24)25)6-7-14(13)19-8-9-21/h1-7,10,15,19,21H,8-9H2,(H2,18,22)