3-methyl-3-(4-methylphenyl)-4-oxidanylidene-pentanal

Systemtic Name: 3-methyl-3-(4-methylphenyl)-4-oxidanylidene-pentanal Openeye Name: 3-methyl-4-oxo-3-(p-tolyl)pentanal CAS Name: 3-methyl-3-(4-methylphenyl)-4-oxopentanal IUPAC Name: 3-methyl-3-(4-methylphenyl)-4-oxopentanal Traditional Name: 4-keto-3-methyl-3-(p-tolyl)valeraldehyde Formula: C13H16O2 MolecularWeight: 204.26494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O2/c1-10-4-6-12(7-5-10)13(3,8-9-14)11(2)15/h4-7,9H,8H2,1-3H3