3-(4-methylcyclohexa-1,3-dien-1-yl)-2-methylidene-butanal

Systemtic Name: 3-(4-methylcyclohexa-1,3-dien-1-yl)-2-methylidene-butanal Openeye Name: 3-(4-methylcyclohexa-1,3-dien-1-yl)-2-methylene-butanal CAS Name: 3-(4-methyl-1-cyclohexa-1,3-dienyl)-2-methylenebutanal IUPAC Name: 3-(4-methylcyclohexa-1,3-dien-1-yl)-2-methylidenebutanal Traditional Name: 2-[1-(4-methylcyclohexa-1,3-dien-1-yl)ethyl]acrolein Formula: C12H16O MolecularWeight: 176.25484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16O/c1-9-4-6-12(7-5-9)11(3)10(2)8-13/h4,6,8,11H,2,5,7H2,1,3H3