(E)-2-(2-carboxyethylsulfanyl)hexadec-3-enoic acid

Systemtic Name: (E)-2-(2-carboxyethylsulfanyl)hexadec-3-enoic acid Openeye Name: (E)-2-(2-carboxyethylsulfanyl)hexadec-3-enoic acid CAS Name: (E)-2-(2-carboxyethylthio)-3-hexadecenoic acid IUPAC Name: (E)-2-(2-carboxyethylsulfanyl)hexadec-3-enoic acid Traditional Name: (E)-2-(2-carboxyethylthio)hexadec-3-enoic acid Formula: C19H34O4S MolecularWeight: 358.53586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC=CC(C(=O)O)SCCC(=O)O

Isomeric SMILES

CCCCCCCCCCCC/C=C/C(C(=O)O)SCCC(=O)O

InChI

InChI=1S/C19H34O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19(22)23)24-16-15-18(20)21/h13-14,17H,2-12,15-16H2,1H3,(H,20,21)(H,22,23)/b14-13+