2-acetamido-5-(3-chlorophenyl)-3-oxidanylidene-pentanoic acid

Systemtic Name: 2-acetamido-5-(3-chlorophenyl)-3-oxidanylidene-pentanoic acid Openeye Name: 2-acetamido-5-(3-chlorophenyl)-3-oxo-pentanoic acid CAS Name: 2-acetamido-5-(3-chlorophenyl)-3-oxopentanoic acid IUPAC Name: 2-acetamido-5-(3-chlorophenyl)-3-oxopentanoic acid Traditional Name: 2-acetamido-5-(3-chlorophenyl)-3-keto-valeric acid Formula: C13H14ClNO4 MolecularWeight: 283.70756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(=O)CCC1=CC(=CC=C1)Cl)C(=O)O

Isomeric SMILES

CC(=O)NC(C(=O)CCC1=CC(=CC=C1)Cl)C(=O)O

InChI

InChI=1S/C13H14ClNO4/c1-8(16)15-12(13(18)19)11(17)6-5-9-3-2-4-10(14)7-9/h2-4,7,12H,5-6H2,1H3,(H,15,16)(H,18,19)