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

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

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