5-(4-chlorophenyl)-3-methyl-pentanoic acid

Systemtic Name: 5-(4-chlorophenyl)-3-methyl-pentanoic acid Openeye Name: 5-(4-chlorophenyl)-3-methyl-pentanoic acid CAS Name: 5-(4-chlorophenyl)-3-methylpentanoic acid IUPAC Name: 5-(4-chlorophenyl)-3-methylpentanoic acid Traditional Name: 5-(4-chlorophenyl)-3-methyl-valeric acid Formula: C12H15ClO2 MolecularWeight: 226.6993

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClO2/c1-9(8-12(14)15)2-3-10-4-6-11(13)7-5-10/h4-7,9H,2-3,8H2,1H3,(H,14,15)