5-[2-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]ethylsulfanyl]pentanoic acid

Systemtic Name: 5-[2-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]ethylsulfanyl]pentanoic acid Openeye Name: 5-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-pyrrolidin-1-yl]ethylsulfanyl]pentanoic acid CAS Name: 5-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-1-pyrrolidinyl]ethylthio]pentanoic acid IUPAC Name: 5-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]pentanoic acid Traditional Name: 5-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-keto-pyrrolidino]ethylthio]valeric acid Formula: C19H33NO4S MolecularWeight: 371.53462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(=O)N1CCSCCCCC(=O)O)O

Isomeric SMILES

CCCCCC(/C=C/C1CCC(=O)N1CCSCCCCC(=O)O)O

InChI

InChI=1S/C19H33NO4S/c1-2-3-4-7-17(21)11-9-16-10-12-18(22)20(16)13-15-25-14-6-5-8-19(23)24/h9,11,16-17,21H,2-8,10,12-15H2,1H3,(H,23,24)/b11-9+