4-[2-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]ethylsulfanyl]pentanoic acid

Systemtic Name: 4-[2-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]ethylsulfanyl]pentanoic acid Openeye Name: 4-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-pyrrolidin-1-yl]ethylsulfanyl]pentanoic acid CAS Name: 4-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-1-pyrrolidinyl]ethylthio]pentanoic acid IUPAC Name: 4-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]pentanoic acid Traditional Name: 4-[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)N1CCSC(C)CCC(=O)O)O

Isomeric SMILES

CCCCCC(/C=C/C1CCC(=O)N1CCSC(C)CCC(=O)O)O

InChI

InChI=1S/C19H33NO4S/c1-3-4-5-6-17(21)10-8-16-9-11-18(22)20(16)13-14-25-15(2)7-12-19(23)24/h8,10,15-17,21H,3-7,9,11-14H2,1-2H3,(H,23,24)/b10-8+