1-(3-chloranyl-4-methyl-phenyl)-2,4-dimethyl-pentan-3-one

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-2,4-dimethyl-pentan-3-one Openeye Name: 1-(3-chloro-4-methyl-phenyl)-2,4-dimethyl-pentan-3-one CAS Name: 1-(3-chloro-4-methylphenyl)-2,4-dimethyl-3-pentanone IUPAC Name: 1-(3-chloro-4-methylphenyl)-2,4-dimethylpentan-3-one Traditional Name: 1-(3-chloro-4-methyl-phenyl)-2,4-dimethyl-pentan-3-one Formula: C14H19ClO MolecularWeight: 238.75306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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