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

Systemtic Name: (2R)-2-ethyl-5-[(2-nitrophenyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2R)-2-ethyl-5-(2-nitroanilino)-5-oxo-pentanoic acid CAS Name: (2R)-2-ethyl-5-(2-nitroanilino)-5-oxopentanoic acid IUPAC Name: (2R)-2-ethyl-5-(2-nitroanilino)-5-oxopentanoic acid Traditional Name: (2R)-2-ethyl-5-keto-5-(2-nitroanilino)valeric acid Formula: C13H16N2O5 MolecularWeight: 280.27654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)NC1=CC=CC=C1[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC[C@H](CCC(=O)NC1=CC=CC=C1[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C13H16N2O5/c1-2-9(13(17)18)7-8-12(16)14-10-5-3-4-6-11(10)15(19)20/h3-6,9H,2,7-8H2,1H3,(H,14,16)(H,17,18)/t9-/m1/s1