1-[1-(4-methylphenyl)cyclohexa-2,4-dien-1-yl]propan-1-one

Systemtic Name: 1-[1-(4-methylphenyl)cyclohexa-2,4-dien-1-yl]propan-1-one Openeye Name: 1-[1-(p-tolyl)cyclohexa-2,4-dien-1-yl]propan-1-one CAS Name: 1-[1-(4-methylphenyl)-1-cyclohexa-2,4-dienyl]-1-propanone IUPAC Name: 1-[1-(4-methylphenyl)cyclohexa-2,4-dien-1-yl]propan-1-one Traditional Name: 1-[1-(p-tolyl)cyclohexa-2,4-dien-1-yl]propan-1-one Formula: C16H18O MolecularWeight: 226.31352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18O/c1-3-15(17)16(11-5-4-6-12-16)14-9-7-13(2)8-10-14/h4-11H,3,12H2,1-2H3