4-chloranyl-5-methyl-3-oxidanyl-1-phenyl-hexan-1-one

Systemtic Name: 4-chloranyl-5-methyl-3-oxidanyl-1-phenyl-hexan-1-one Openeye Name: 4-chloro-3-hydroxy-5-methyl-1-phenyl-hexan-1-one CAS Name: 4-chloro-3-hydroxy-5-methyl-1-phenyl-1-hexanone IUPAC Name: 4-chloro-3-hydroxy-5-methyl-1-phenylhexan-1-one Traditional Name: 4-chloro-3-hydroxy-5-methyl-1-phenyl-hexan-1-one Formula: C13H17ClO2 MolecularWeight: 240.72588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17ClO2/c1-9(2)13(14)12(16)8-11(15)10-6-4-3-5-7-10/h3-7,9,12-13,16H,8H2,1-2H3