methyl 4-(2-oxidanylidenecyclohexyl)but-2-ynoate

Systemtic Name: methyl 4-(2-oxidanylidenecyclohexyl)but-2-ynoate Openeye Name: methyl 4-(2-oxocyclohexyl)but-2-ynoate CAS Name: 4-(2-oxocyclohexyl)-2-butynoic acid methyl ester IUPAC Name: methyl 4-(2-oxocyclohexyl)but-2-ynoate Traditional Name: 4-(2-ketocyclohexyl)but-2-ynoic acid methyl ester Formula: C11H14O3 MolecularWeight: 194.22706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CCC1CCCCC1=O

Isomeric SMILES

COC(=O)C#CCC1CCCCC1=O

InChI

InChI=1S/C11H14O3/c1-14-11(13)8-4-6-9-5-2-3-7-10(9)12/h9H,2-3,5-7H2,1H3