6-chloranyl-2-methyl-4-oxidanylidene-2-(phenylmethyl)hexanoic acid

Systemtic Name: 6-chloranyl-2-methyl-4-oxidanylidene-2-(phenylmethyl)hexanoic acid Openeye Name: 2-benzyl-6-chloro-2-methyl-4-oxo-hexanoic acid CAS Name: 6-chloro-2-methyl-4-oxo-2-(phenylmethyl)hexanoic acid IUPAC Name: 2-benzyl-6-chloro-2-methyl-4-oxohexanoic acid Traditional Name: 2-benzyl-6-chloro-4-keto-2-methyl-hexanoic acid Formula: C14H17ClO3 MolecularWeight: 268.73598

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)(CC(=O)CCCl)C(=O)O

Isomeric SMILES

CC(CC1=CC=CC=C1)(CC(=O)CCCl)C(=O)O

InChI

InChI=1S/C14H17ClO3/c1-14(13(17)18,10-12(16)7-8-15)9-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H,17,18)