methyl 2-(2-chlorophenyl)-4-methyl-pentanoate

Systemtic Name: methyl 2-(2-chlorophenyl)-4-methyl-pentanoate Openeye Name: methyl 2-(2-chlorophenyl)-4-methyl-pentanoate CAS Name: 2-(2-chlorophenyl)-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-(2-chlorophenyl)-4-methylpentanoate Traditional Name: 2-(2-chlorophenyl)-4-methyl-valeric acid methyl ester Formula: C13H17ClO2 MolecularWeight: 240.72588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1Cl)C(=O)OC

Isomeric SMILES

CC(C)CC(C1=CC=CC=C1Cl)C(=O)OC

InChI

InChI=1S/C13H17ClO2/c1-9(2)8-11(13(15)16-3)10-6-4-5-7-12(10)14/h4-7,9,11H,8H2,1-3H3