(1R,6S)-4-methyl-6-(2-methylbut-3-yn-2-yloxycarbonyl)cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-4-methyl-6-(2-methylbut-3-yn-2-yloxycarbonyl)cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-(1,1-dimethylprop-2-ynoxycarbonyl)-4-methyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-4-methyl-6-[2-methylbut-3-yn-2-yloxy(oxo)methyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-4-methyl-6-(2-methylbut-3-yn-2-yloxycarbonyl)cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-(1,1-dimethylprop-2-ynoxycarbonyl)-4-methyl-cyclohex-3-ene-1-carboxylate Formula: C14H17O4- MolecularWeight: 249.28238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(C1)C(=O)OC(C)(C)C#C)C(=O)[O-]

Isomeric SMILES

CC1=CC[C@H]([C@H](C1)C(=O)OC(C)(C)C#C)C(=O)[O-]

InChI

InChI=1S/C14H18O4/c1-5-14(3,4)18-13(17)11-8-9(2)6-7-10(11)12(15)16/h1,6,10-11H,7-8H2,2-4H3,(H,15,16)/p-1/t10-,11+/m1/s1