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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C=CC1CCC(=O)N1CCSCCCC(=O)O)O

Isomeric SMILES

CCCCCC(C)(/C=C/C1CCC(=O)N1CCSCCCC(=O)O)O

InChI

InChI=1S/C19H33NO4S/c1-3-4-5-11-19(2,24)12-10-16-8-9-17(21)20(16)13-15-25-14-6-7-18(22)23/h10,12,16,24H,3-9,11,13-15H2,1-2H3,(H,22,23)/b12-10+