2-methyl-2-(4-methylphenyl)hex-5-ynal

Systemtic Name: 2-methyl-2-(4-methylphenyl)hex-5-ynal Openeye Name: 2-methyl-2-(p-tolyl)hex-5-ynal CAS Name: 2-methyl-2-(4-methylphenyl)-5-hexynal IUPAC Name: 2-methyl-2-(4-methylphenyl)hex-5-ynal Traditional Name: 2-methyl-2-(p-tolyl)hex-5-ynal Formula: C14H16O MolecularWeight: 200.27624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O/c1-4-5-10-14(3,11-15)13-8-6-12(2)7-9-13/h1,6-9,11H,5,10H2,2-3H3