(E)-3-(2,6,6-trimethylcyclohexen-1-yl)prop-2-enal

Systemtic Name: (E)-3-(2,6,6-trimethylcyclohexen-1-yl)prop-2-enal Openeye Name: (E)-3-(2,6,6-trimethylcyclohexen-1-yl)prop-2-enal CAS Name: (E)-3-(2,6,6-trimethyl-1-cyclohexenyl)-2-propenal IUPAC Name: (E)-3-(2,6,6-trimethylcyclohexen-1-yl)prop-2-enal Traditional Name: (E)-3-(2,6,6-trimethylcyclohexen-1-yl)acrolein Formula: C12H18O MolecularWeight: 178.27072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC=O

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C=O

InChI

InChI=1S/C12H18O/c1-10-6-4-8-12(2,3)11(10)7-5-9-13/h5,7,9H,4,6,8H2,1-3H3/b7-5+