(2S)-2-methyl-2-(4-methylphenyl)but-3-enal

Systemtic Name: (2S)-2-methyl-2-(4-methylphenyl)but-3-enal Openeye Name: (2S)-2-methyl-2-(p-tolyl)but-3-enal CAS Name: (2S)-2-methyl-2-(4-methylphenyl)-3-butenal IUPAC Name: (2S)-2-methyl-2-(4-methylphenyl)but-3-enal Traditional Name: (2S)-2-methyl-2-(p-tolyl)but-3-enal Formula: C12H14O MolecularWeight: 174.23896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)[C@](C)(C=C)C=O

InChI

InChI=1S/C12H14O/c1-4-12(3,9-13)11-7-5-10(2)6-8-11/h4-9H,1H2,2-3H3/t12-/m1/s1