methyl (Z)-3-(3,3,7-trimethyl-4,5-dihydro-2H-oxepin-2-yl)prop-2-enoate

Systemtic Name: methyl (Z)-3-(3,3,7-trimethyl-4,5-dihydro-2H-oxepin-2-yl)prop-2-enoate Openeye Name: methyl (Z)-3-(3,3,7-trimethyl-4,5-dihydro-2H-oxepin-2-yl)prop-2-enoate CAS Name: (Z)-3-(3,3,7-trimethyl-4,5-dihydro-2H-oxepin-2-yl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-(3,3,7-trimethyl-4,5-dihydro-2H-oxepin-2-yl)prop-2-enoate Traditional Name: (Z)-3-(3,3,7-trimethyl-4,5-dihydro-2H-oxepin-2-yl)acrylic acid methyl ester Formula: C13H20O3 MolecularWeight: 224.2961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CCCC(C(O1)C=CC(=O)OC)(C)C

Isomeric SMILES

CC1=CCCC(C(O1)/C=C\C(=O)OC)(C)C

InChI

InChI=1S/C13H20O3/c1-10-6-5-9-13(2,3)11(16-10)7-8-12(14)15-4/h6-8,11H,5,9H2,1-4H3/b8-7-