ethyl (4R,6S)-6-(furan-3-yl)-7,7-dimethyl-4-oxidanyl-oct-2-ynoate

Systemtic Name: ethyl (4R,6S)-6-(furan-3-yl)-7,7-dimethyl-4-oxidanyl-oct-2-ynoate Openeye Name: ethyl (4R,6S)-6-(3-furyl)-4-hydroxy-7,7-dimethyl-oct-2-ynoate CAS Name: (4R,6S)-6-(3-furanyl)-4-hydroxy-7,7-dimethyl-2-octynoic acid ethyl ester IUPAC Name: ethyl (4R,6S)-6-(furan-3-yl)-4-hydroxy-7,7-dimethyloct-2-ynoate Traditional Name: (4R,6S)-6-(3-furyl)-4-hydroxy-7,7-dimethyl-oct-2-ynoic acid ethyl ester Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CC(CC(C1=COC=C1)C(C)(C)C)O

Isomeric SMILES

CCOC(=O)C#C[C@@H](C[C@H](C1=COC=C1)C(C)(C)C)O

InChI

InChI=1S/C16H22O4/c1-5-20-15(18)7-6-13(17)10-14(16(2,3)4)12-8-9-19-11-12/h8-9,11,13-14,17H,5,10H2,1-4H3/t13-,14+/m0/s1