1-(5-chloranyl-4-methyl-2-oxidanyl-phenyl)hexan-1-one

Systemtic Name: 1-(5-chloranyl-4-methyl-2-oxidanyl-phenyl)hexan-1-one Openeye Name: 1-(5-chloro-2-hydroxy-4-methyl-phenyl)hexan-1-one CAS Name: 1-(5-chloro-2-hydroxy-4-methylphenyl)-1-hexanone IUPAC Name: 1-(5-chloro-2-hydroxy-4-methylphenyl)hexan-1-one Traditional Name: 1-(5-chloro-2-hydroxy-4-methyl-phenyl)hexan-1-one Formula: C13H17ClO2 MolecularWeight: 240.72588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=CC(=C(C=C1O)C)Cl

Isomeric SMILES

CCCCCC(=O)C1=CC(=C(C=C1O)C)Cl

InChI

InChI=1S/C13H17ClO2/c1-3-4-5-6-12(15)10-8-11(14)9(2)7-13(10)16/h7-8,16H,3-6H2,1-2H3