methyl (E)-3-(2,6,6-trimethyl-3-oxidanyl-cyclohexen-1-yl)prop-2-enoate

Systemtic Name: methyl (E)-3-(2,6,6-trimethyl-3-oxidanyl-cyclohexen-1-yl)prop-2-enoate Openeye Name: methyl (E)-3-(3-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl)prop-2-enoate CAS Name: (E)-3-(3-hydroxy-2,6,6-trimethyl-1-cyclohexenyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(3-hydroxy-2,6,6-trimethylcyclohexen-1-yl)prop-2-enoate Traditional Name: (E)-3-(3-hydroxy-2,6,6-trimethyl-cyclohexen-1-yl)acrylic acid methyl ester Formula: C13H20O3 MolecularWeight: 224.2961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1O)(C)C)C=CC(=O)OC

Isomeric SMILES

CC1=C(C(CCC1O)(C)C)/C=C/C(=O)OC

InChI

InChI=1S/C13H20O3/c1-9-10(5-6-12(15)16-4)13(2,3)8-7-11(9)14/h5-6,11,14H,7-8H2,1-4H3/b6-5+