2-(cyclopentylamino)-4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-(cyclopentylamino)-4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 2-(cyclopentylamino)-4-(3-nitroanilino)-4-oxo-butanoic acid CAS Name: 2-(cyclopentylamino)-4-(3-nitroanilino)-4-oxobutanoic acid IUPAC Name: 2-(cyclopentylamino)-4-(3-nitroanilino)-4-oxobutanoic acid Traditional Name: 2-(cyclopentylamino)-4-keto-4-(3-nitroanilino)butyric acid Formula: C15H19N3O5 MolecularWeight: 321.32846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CCC(C1)NC(CC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H19N3O5/c19-14(17-11-6-3-7-12(8-11)18(22)23)9-13(15(20)21)16-10-4-1-2-5-10/h3,6-8,10,13,16H,1-2,4-5,9H2,(H,17,19)(H,20,21)