(3S)-3-(3,4-dimethylphenyl)-4-methyl-pentanoyl chloride

Systemtic Name: (3S)-3-(3,4-dimethylphenyl)-4-methyl-pentanoyl chloride Openeye Name: (3S)-3-(3,4-dimethylphenyl)-4-methyl-pentanoyl chloride CAS Name: (3S)-3-(3,4-dimethylphenyl)-4-methylpentanoyl chloride IUPAC Name: (3S)-3-(3,4-dimethylphenyl)-4-methylpentanoyl chloride Traditional Name: (3S)-3-(3,4-dimethylphenyl)-4-methyl-valeryl chloride Formula: C14H19ClO MolecularWeight: 238.75306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)[C@@H](CC(=O)Cl)C(C)C)C

InChI

InChI=1S/C14H19ClO/c1-9(2)13(8-14(15)16)12-6-5-10(3)11(4)7-12/h5-7,9,13H,8H2,1-4H3/t13-/m0/s1