1-cyclohepta-1,3,5-trien-1-yl-3-methyl-3-oxidanyl-butan-1-one

Systemtic Name: 1-cyclohepta-1,3,5-trien-1-yl-3-methyl-3-oxidanyl-butan-1-one Openeye Name: 1-cyclohepta-1,3,5-trien-1-yl-3-hydroxy-3-methyl-butan-1-one CAS Name: 1-(1-cyclohepta-1,3,5-trienyl)-3-hydroxy-3-methyl-1-butanone IUPAC Name: 1-cyclohepta-1,3,5-trien-1-yl-3-hydroxy-3-methylbutan-1-one Traditional Name: 1-cyclohepta-1,3,5-trien-1-yl-3-hydroxy-3-methyl-butan-1-one Formula: C12H16O2 MolecularWeight: 192.25424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O2/c1-12(2,14)9-11(13)10-7-5-3-4-6-8-10/h3-7,14H,8-9H2,1-2H3