4-[[1-(4-nitrophenyl)-3-oxidanylidene-3-phenyl-propyl]amino]benzoic acid

Systemtic Name: 4-[[1-(4-nitrophenyl)-3-oxidanylidene-3-phenyl-propyl]amino]benzoic acid Openeye Name: 4-[[1-(4-nitrophenyl)-3-oxo-3-phenyl-propyl]amino]benzoic acid CAS Name: 4-[[1-(4-nitrophenyl)-3-oxo-3-phenylpropyl]amino]benzoic acid IUPAC Name: 4-[[1-(4-nitrophenyl)-3-oxo-3-phenylpropyl]amino]benzoic acid Traditional Name: 4-[[3-keto-1-(4-nitrophenyl)-3-phenyl-propyl]amino]benzoic acid Formula: C22H18N2O5 MolecularWeight: 390.38872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(C2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC(C2=CC=C(C=C2)[N+](=O)[O-])NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H18N2O5/c25-21(16-4-2-1-3-5-16)14-20(15-8-12-19(13-9-15)24(28)29)23-18-10-6-17(7-11-18)22(26)27/h1-13,20,23H,14H2,(H,26,27)