5-[(2-chlorophenyl)amino]-3-methyl-2-(2-methylpropyl)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(2-chlorophenyl)amino]-3-methyl-2-(2-methylpropyl)-5-oxidanylidene-pentanoic acid Openeye Name: 5-(2-chloroanilino)-2-isobutyl-3-methyl-5-oxo-pentanoic acid CAS Name: 5-(2-chloroanilino)-3-methyl-2-(2-methylpropyl)-5-oxopentanoic acid IUPAC Name: 5-(2-chloroanilino)-3-methyl-2-(2-methylpropyl)-5-oxopentanoic acid Traditional Name: 5-(2-chloroanilino)-2-isobutyl-5-keto-3-methyl-valeric acid Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C)CC(=O)NC1=CC=CC=C1Cl)C(=O)O

Isomeric SMILES

CC(C)CC(C(C)CC(=O)NC1=CC=CC=C1Cl)C(=O)O

InChI

InChI=1S/C16H22ClNO3/c1-10(2)8-12(16(20)21)11(3)9-15(19)18-14-7-5-4-6-13(14)17/h4-7,10-12H,8-9H2,1-3H3,(H,18,19)(H,20,21)