[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] prop-2-ynoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] prop-2-ynoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] prop-2-ynoate CAS Name: 2-propynoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] prop-2-ynoate Traditional Name: propiolic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C13H20O2 MolecularWeight: 208.2967

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C#C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C#C)C(C)C

InChI

InChI=1S/C13H20O2/c1-5-13(14)15-12-8-10(4)6-7-11(12)9(2)3/h1,9-12H,6-8H2,2-4H3/t10-,11+,12-/m1/s1