3-[(4-methylphenyl)methyl]but-3-en-2-one

Systemtic Name: 3-[(4-methylphenyl)methyl]but-3-en-2-one Openeye Name: 3-(p-tolylmethyl)but-3-en-2-one CAS Name: 3-[(4-methylphenyl)methyl]-3-buten-2-one IUPAC Name: 3-[(4-methylphenyl)methyl]but-3-en-2-one Traditional Name: 3-(4-methylbenzyl)but-3-en-2-one Formula: C12H14O MolecularWeight: 174.23896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O/c1-9-4-6-12(7-5-9)8-10(2)11(3)13/h4-7H,2,8H2,1,3H3