[2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl] 2-azanyl-5-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[[2-(phenylcarbonyl)phenyl]amino]ethyl] 2-azanyl-5-nitro-benzoate Openeye Name: [2-(2-benzoylanilino)-2-oxo-ethyl] 2-amino-5-nitro-benzoate CAS Name: 2-amino-5-nitrobenzoic acid [2-(2-benzoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylanilino)-2-oxoethyl] 2-amino-5-nitrobenzoate Traditional Name: 2-amino-5-nitro-benzoic acid [2-(2-benzoylanilino)-2-keto-ethyl] ester Formula: C22H17N3O6 MolecularWeight: 419.38688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N

InChI

InChI=1S/C22H17N3O6/c23-18-11-10-15(25(29)30)12-17(18)22(28)31-13-20(26)24-19-9-5-4-8-16(19)21(27)14-6-2-1-3-7-14/h1-12H,13,23H2,(H,24,26)