2-[4-[(1R,2S)-2-[(E)-hept-1-enyl]cyclopentyl]butylsulfanyl]ethanoate

Systemtic Name: 2-[4-[(1R,2S)-2-[(E)-hept-1-enyl]cyclopentyl]butylsulfanyl]ethanoate Openeye Name: 2-[4-[(1R,2S)-2-[(E)-hept-1-enyl]cyclopentyl]butylsulfanyl]acetate CAS Name: 2-[4-[(1R,2S)-2-[(E)-hept-1-enyl]cyclopentyl]butylthio]acetate IUPAC Name: 2-[4-[(1R,2S)-2-[(E)-hept-1-enyl]cyclopentyl]butylsulfanyl]acetate Traditional Name: 2-[4-[(1R,2S)-2-[(E)-hept-1-enyl]cyclopentyl]butylthio]acetate Formula: C18H31O2S- MolecularWeight: 311.50254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC1CCCC1CCCCSCC(=O)[O-]

Isomeric SMILES

CCCCC/C=C/[C@H]1CCC[C@@H]1CCCCSCC(=O)[O-]

InChI

InChI=1S/C18H32O2S/c1-2-3-4-5-6-10-16-12-9-13-17(16)11-7-8-14-21-15-18(19)20/h6,10,16-17H,2-5,7-9,11-15H2,1H3,(H,19,20)/p-1/b10-6+/t16-,17-/m0/s1