[(E,4R,5S)-7-cyclohexyl-4,6-dimethyl-5-oxidanyl-hept-6-en-2-ynyl] 2,2-dimethylpropanoate

Systemtic Name: [(E,4R,5S)-7-cyclohexyl-4,6-dimethyl-5-oxidanyl-hept-6-en-2-ynyl] 2,2-dimethylpropanoate Openeye Name: [(E,4R,5S)-7-cyclohexyl-5-hydroxy-4,6-dimethyl-hept-6-en-2-ynyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(E,4R,5S)-7-cyclohexyl-5-hydroxy-4,6-dimethylhept-6-en-2-ynyl] ester IUPAC Name: [(E,4R,5S)-7-cyclohexyl-5-hydroxy-4,6-dimethylhept-6-en-2-ynyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(E,4R,5S)-7-cyclohexyl-5-hydroxy-4,6-dimethyl-hept-6-en-2-ynyl] ester Formula: C20H32O3 MolecularWeight: 320.46628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CCOC(=O)C(C)(C)C)C(C(=CC1CCCCC1)C)O

Isomeric SMILES

C[C@H](C#CCOC(=O)C(C)(C)C)[C@@H](/C(=C/C1CCCCC1)/C)O

InChI

InChI=1S/C20H32O3/c1-15(10-9-13-23-19(22)20(3,4)5)18(21)16(2)14-17-11-7-6-8-12-17/h14-15,17-18,21H,6-8,11-13H2,1-5H3/b16-14+/t15-,18+/m1/s1