1-[5-(3-chlorophenyl)-6,6-dimethyl-5-oxidanyl-cyclohexa-1,3-dien-1-yl]propan-1-one

Systemtic Name: 1-[5-(3-chlorophenyl)-6,6-dimethyl-5-oxidanyl-cyclohexa-1,3-dien-1-yl]propan-1-one Openeye Name: 1-[5-(3-chlorophenyl)-5-hydroxy-6,6-dimethyl-cyclohexa-1,3-dien-1-yl]propan-1-one CAS Name: 1-[5-(3-chlorophenyl)-5-hydroxy-6,6-dimethyl-1-cyclohexa-1,3-dienyl]-1-propanone IUPAC Name: 1-[5-(3-chlorophenyl)-5-hydroxy-6,6-dimethylcyclohexa-1,3-dien-1-yl]propan-1-one Traditional Name: 1-[5-(3-chlorophenyl)-5-hydroxy-6,6-dimethyl-cyclohexa-1,3-dien-1-yl]propan-1-one Formula: C17H19ClO2 MolecularWeight: 290.78456

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=CC(C1(C)C)(C2=CC(=CC=C2)Cl)O

Isomeric SMILES

CCC(=O)C1=CC=CC(C1(C)C)(C2=CC(=CC=C2)Cl)O

InChI

InChI=1S/C17H19ClO2/c1-4-15(19)14-9-6-10-17(20,16(14,2)3)12-7-5-8-13(18)11-12/h5-11,20H,4H2,1-3H3