ethyl (E)-3-[(1R,2R)-1-methyl-2-oxidanyl-2-prop-2-ynyl-cycloheptyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[(1R,2R)-1-methyl-2-oxidanyl-2-prop-2-ynyl-cycloheptyl]prop-2-enoate Openeye Name: ethyl (E)-3-[(1R,2R)-2-hydroxy-1-methyl-2-prop-2-ynyl-cycloheptyl]prop-2-enoate CAS Name: (E)-3-[(1R,2R)-2-hydroxy-1-methyl-2-prop-2-ynylcycloheptyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(1R,2R)-2-hydroxy-1-methyl-2-prop-2-ynylcycloheptyl]prop-2-enoate Traditional Name: (E)-3-[(1R,2R)-2-hydroxy-1-methyl-2-propargyl-cycloheptyl]acrylic acid ethyl ester Formula: C16H24O3 MolecularWeight: 264.35996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1(CCCCCC1(CC#C)O)C

Isomeric SMILES

CCOC(=O)/C=C/[C@]1(CCCCC[C@]1(CC#C)O)C

InChI

InChI=1S/C16H24O3/c1-4-10-16(18)12-8-6-7-11-15(16,3)13-9-14(17)19-5-2/h1,9,13,18H,5-8,10-12H2,2-3H3/b13-9+/t15-,16+/m1/s1