5-[(2-nitrophenyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(2-nitrophenyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(2-nitroanilino)-5-oxo-pentanoic acid CAS Name: 5-(2-nitroanilino)-5-oxopentanoic acid IUPAC Name: 5-(2-nitroanilino)-5-oxopentanoic acid Traditional Name: 5-keto-5-(2-nitroanilino)valeric acid Formula: C11H12N2O5 MolecularWeight: 252.22338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H12N2O5/c14-10(6-3-7-11(15)16)12-8-4-1-2-5-9(8)13(17)18/h1-2,4-5H,3,6-7H2,(H,12,14)(H,15,16)