1-(3-chlorophenyl)-2,4,4-trimethyl-pentan-1-one

Systemtic Name: 1-(3-chlorophenyl)-2,4,4-trimethyl-pentan-1-one Openeye Name: 1-(3-chlorophenyl)-2,4,4-trimethyl-pentan-1-one CAS Name: 1-(3-chlorophenyl)-2,4,4-trimethyl-1-pentanone IUPAC Name: 1-(3-chlorophenyl)-2,4,4-trimethylpentan-1-one Traditional Name: 1-(3-chlorophenyl)-2,4,4-trimethyl-pentan-1-one Formula: C14H19ClO MolecularWeight: 238.75306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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