methyl 14-[(4S,5S)-5-ethyl-2,2-dimethyl-1,3-dioxolan-4-yl]tetradeca-9,12-diynoate

Systemtic Name: methyl 14-[(4S,5S)-5-ethyl-2,2-dimethyl-1,3-dioxolan-4-yl]tetradeca-9,12-diynoate Openeye Name: methyl 14-[(4S,5S)-5-ethyl-2,2-dimethyl-1,3-dioxolan-4-yl]tetradeca-9,12-diynoate CAS Name: 14-[(4S,5S)-5-ethyl-2,2-dimethyl-1,3-dioxolan-4-yl]tetradeca-9,12-diynoic acid methyl ester IUPAC Name: methyl 14-[(4S,5S)-5-ethyl-2,2-dimethyl-1,3-dioxolan-4-yl]tetradeca-9,12-diynoate Traditional Name: 14-[(4S,5S)-5-ethyl-2,2-dimethyl-1,3-dioxolan-4-yl]tetradeca-9,12-diynoic acid methyl ester Formula: C22H34O4 MolecularWeight: 362.50296

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(OC(O1)(C)C)CC#CCC#CCCCCCCCC(=O)OC

Isomeric SMILES

CC[C@H]1[C@@H](OC(O1)(C)C)CC#CCC#CCCCCCCCC(=O)OC

InChI

InChI=1S/C22H34O4/c1-5-19-20(26-22(2,3)25-19)17-15-13-11-9-7-6-8-10-12-14-16-18-21(23)24-4/h19-20H,5-6,8,10-12,14,16-18H2,1-4H3/t19-,20-/m0/s1