4-[(5R)-2-oxidanylidene-5-[(E,3S)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]butylsulfanyl ethanoate

Systemtic Name: 4-[(5R)-2-oxidanylidene-5-[(E,3S)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]butylsulfanyl ethanoate Openeye Name: 4-[(2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxo-pyrrolidin-1-yl]butylsulfanyl acetate CAS Name: acetic acid [4-[(2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxo-1-pyrrolidinyl]butylthio] ester IUPAC Name: 4-[(2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxopyrrolidin-1-yl]butylsulfanyl acetate Traditional Name: acetic acid [4-[(2R)-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-keto-pyrrolidino]butylthio] ester Formula: C18H31NO4S MolecularWeight: 357.50804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(=O)N1CCCCSOC(=O)C)O

Isomeric SMILES

CCCCC[C@@H](/C=C/[C@H]1CCC(=O)N1CCCCSOC(=O)C)O

InChI

InChI=1S/C18H31NO4S/c1-3-4-5-8-17(21)11-9-16-10-12-18(22)19(16)13-6-7-14-24-23-15(2)20/h9,11,16-17,21H,3-8,10,12-14H2,1-2H3/b11-9+/t16-,17-/m0/s1