tert-butyl 8-[(1S,4R,5S)-4-oxidanyl-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoate

Systemtic Name: tert-butyl 8-[(1S,4R,5S)-4-oxidanyl-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoate Openeye Name: tert-butyl 8-[(1S,4R,5S)-4-hydroxy-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoate CAS Name: 8-[(1S,4R,5S)-4-hydroxy-5-[(Z)-pent-2-enyl]-1-cyclopent-2-enyl]octanoic acid tert-butyl ester IUPAC Name: tert-butyl 8-[(1S,4R,5S)-4-hydroxy-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoate Traditional Name: 8-[(1S,4R,5S)-4-hydroxy-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]caprylic acid tert-butyl ester Formula: C22H38O3 MolecularWeight: 350.53532

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCC1C(C=CC1O)CCCCCCCC(=O)OC(C)(C)C

Isomeric SMILES

CC/C=C\C[C@H]1[C@H](C=C[C@H]1O)CCCCCCCC(=O)OC(C)(C)C

InChI

InChI=1S/C22H38O3/c1-5-6-10-14-19-18(16-17-20(19)23)13-11-8-7-9-12-15-21(24)25-22(2,3)4/h6,10,16-20,23H,5,7-9,11-15H2,1-4H3/b10-6-/t18-,19-,20+/m0/s1