(3S)-5-[(2-chlorophenyl)amino]-3-methyl-5-oxidanylidene-pentanoate

Systemtic Name: (3S)-5-[(2-chlorophenyl)amino]-3-methyl-5-oxidanylidene-pentanoate Openeye Name: (3S)-5-(2-chloroanilino)-3-methyl-5-oxo-pentanoate CAS Name: (3S)-5-(2-chloroanilino)-3-methyl-5-oxopentanoate IUPAC Name: (3S)-5-(2-chloroanilino)-3-methyl-5-oxopentanoate Traditional Name: (3S)-5-(2-chloroanilino)-5-keto-3-methyl-valerate Formula: C12H13ClNO3- MolecularWeight: 254.68952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=CC=C1Cl)CC(=O)[O-]

Isomeric SMILES

C[C@@H](CC(=O)NC1=CC=CC=C1Cl)CC(=O)[O-]

InChI

InChI=1S/C12H14ClNO3/c1-8(7-12(16)17)6-11(15)14-10-5-3-2-4-9(10)13/h2-5,8H,6-7H2,1H3,(H,14,15)(H,16,17)/p-1/t8-/m0/s1