ethyl (1R,2S,3S)-3-hex-1-ynyl-1,2-dimethyl-2-oxidanyl-cyclopentane-1-carboxylate

Systemtic Name: ethyl (1R,2S,3S)-3-hex-1-ynyl-1,2-dimethyl-2-oxidanyl-cyclopentane-1-carboxylate Openeye Name: ethyl (1R,2S,3S)-3-hex-1-ynyl-2-hydroxy-1,2-dimethyl-cyclopentanecarboxylate CAS Name: (1R,2S,3S)-3-hex-1-ynyl-2-hydroxy-1,2-dimethyl-1-cyclopentanecarboxylic acid ethyl ester IUPAC Name: ethyl (1R,2S,3S)-3-hex-1-ynyl-2-hydroxy-1,2-dimethylcyclopentane-1-carboxylate Traditional Name: (1R,2S,3S)-3-hex-1-ynyl-2-hydroxy-1,2-dimethyl-cyclopentanecarboxylic acid ethyl ester Formula: C16H26O3 MolecularWeight: 266.37584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1CCC(C1(C)O)(C)C(=O)OCC

Isomeric SMILES

CCCCC#C[C@@H]1CC[C@@]([C@@]1(C)O)(C)C(=O)OCC

InChI

InChI=1S/C16H26O3/c1-5-7-8-9-10-13-11-12-15(3,16(13,4)18)14(17)19-6-2/h13,18H,5-8,11-12H2,1-4H3/t13-,15+,16+/m1/s1