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

Systemtic Name: 2-methyl-4-[2-[2-oxidanylidene-5-[(E)-3-oxidanyloct-1-enyl]pyrrolidin-1-yl]ethylsulfanyl]butanoic acid Openeye Name: 4-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-pyrrolidin-1-yl]ethylsulfanyl]-2-methyl-butanoic acid CAS Name: 4-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxo-1-pyrrolidinyl]ethylthio]-2-methylbutanoic acid IUPAC Name: 4-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-oxopyrrolidin-1-yl]ethylsulfanyl]-2-methylbutanoic acid Traditional Name: 4-[2-[2-[(E)-3-hydroxyoct-1-enyl]-5-keto-pyrrolidino]ethylthio]-2-methyl-butyric acid Formula: C19H33NO4S MolecularWeight: 371.53462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(=O)N1CCSCCC(C)C(=O)O)O

Isomeric SMILES

CCCCCC(/C=C/C1CCC(=O)N1CCSCCC(C)C(=O)O)O

InChI

InChI=1S/C19H33NO4S/c1-3-4-5-6-17(21)9-7-16-8-10-18(22)20(16)12-14-25-13-11-15(2)19(23)24/h7,9,15-17,21H,3-6,8,10-14H2,1-2H3,(H,23,24)/b9-7+