methyl (2E)-2-(2-ethynyl-3-oxidanyl-cyclohexylidene)ethanoate

Systemtic Name: methyl (2E)-2-(2-ethynyl-3-oxidanyl-cyclohexylidene)ethanoate Openeye Name: methyl (2E)-2-(2-ethynyl-3-hydroxy-cyclohexylidene)acetate CAS Name: (2E)-2-(2-ethynyl-3-hydroxycyclohexylidene)acetic acid methyl ester IUPAC Name: methyl (2E)-2-(2-ethynyl-3-hydroxycyclohexylidene)acetate Traditional Name: (2E)-2-(2-ethynyl-3-hydroxy-cyclohexylidene)acetic acid methyl ester Formula: C11H14O3 MolecularWeight: 194.22706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C1CCCC(C1C#C)O

Isomeric SMILES

COC(=O)/C=C/1\CCCC(C1C#C)O

InChI

InChI=1S/C11H14O3/c1-3-9-8(7-11(13)14-2)5-4-6-10(9)12/h1,7,9-10,12H,4-6H2,2H3/b8-7+