methyl (1R,5S)-1-(3,3-diethoxyprop-1-ynyl)-2,2-dimethyl-6-oxidanylidene-5-prop-2-enyl-cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,5S)-1-(3,3-diethoxyprop-1-ynyl)-2,2-dimethyl-6-oxidanylidene-5-prop-2-enyl-cyclohexane-1-carboxylate Openeye Name: methyl (1R,5S)-5-allyl-1-(3,3-diethoxyprop-1-ynyl)-2,2-dimethyl-6-oxo-cyclohexanecarboxylate CAS Name: (1R,5S)-1-(3,3-diethoxyprop-1-ynyl)-2,2-dimethyl-6-oxo-5-prop-2-enyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-1-(3,3-diethoxyprop-1-ynyl)-2,2-dimethyl-6-oxo-5-prop-2-enylcyclohexane-1-carboxylate Traditional Name: (1R,5S)-5-allyl-1-(3,3-diethoxyprop-1-ynyl)-6-keto-2,2-dimethyl-cyclohexanecarboxylic acid methyl ester Formula: C20H30O5 MolecularWeight: 350.4492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C#CC1(C(=O)C(CCC1(C)C)CC=C)C(=O)OC)OCC

Isomeric SMILES

CCOC(C#C[C@]1(C(=O)[C@@H](CCC1(C)C)CC=C)C(=O)OC)OCC

InChI

InChI=1S/C20H30O5/c1-7-10-15-11-13-19(4,5)20(17(15)21,18(22)23-6)14-12-16(24-8-2)25-9-3/h7,15-16H,1,8-11,13H2,2-6H3/t15-,20+/m1/s1