[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 2-(2-benzamidoethanoylamino)ethanoate

Systemtic Name: [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 2-(2-benzamidoethanoylamino)ethanoate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl] 2-[(2-benzamidoacetyl)amino]acetate CAS Name: 2-[(2-benzamido-1-oxoethyl)amino]acetic acid [2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-nitrophenyl)-2-oxoethyl] 2-[(2-benzamidoacetyl)amino]acetate Traditional Name: 2-(hippuroylamino)acetic acid [2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C19H17N3O7 MolecularWeight: 399.35418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O7/c23-16(13-6-8-15(9-7-13)22(27)28)12-29-18(25)11-20-17(24)10-21-19(26)14-4-2-1-3-5-14/h1-9H,10-12H2,(H,20,24)(H,21,26)