(3S)-3-(4-tert-butylphenyl)-4,4-dimethyl-pentanoyl chloride

Systemtic Name: (3S)-3-(4-tert-butylphenyl)-4,4-dimethyl-pentanoyl chloride Openeye Name: (3S)-3-(4-tert-butylphenyl)-4,4-dimethyl-pentanoyl chloride CAS Name: (3S)-3-(4-tert-butylphenyl)-4,4-dimethylpentanoyl chloride IUPAC Name: (3S)-3-(4-tert-butylphenyl)-4,4-dimethylpentanoyl chloride Traditional Name: (3S)-3-(4-tert-butylphenyl)-4,4-dimethyl-valeryl chloride Formula: C17H25ClO MolecularWeight: 280.8328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25ClO/c1-16(2,3)13-9-7-12(8-10-13)14(11-15(18)19)17(4,5)6/h7-10,14H,11H2,1-6H3/t14-/m1/s1