(E)-6-(sulfanylmethyl)undec-4-enedioic acid

Systemtic Name: (E)-6-(sulfanylmethyl)undec-4-enedioic acid Openeye Name: (E)-6-(sulfanylmethyl)undec-4-enedioic acid CAS Name: (E)-6-(mercaptomethyl)-4-undecenedioic acid IUPAC Name: (E)-6-(sulfanylmethyl)undec-4-enedioic acid Traditional Name: (E)-6-(mercaptomethyl)undec-4-enedioic acid Formula: C12H20O4S MolecularWeight: 260.3498

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(=O)O)CC(CS)C=CCCC(=O)O

Isomeric SMILES

C(CCC(=O)O)CC(CS)/C=C/CCC(=O)O

InChI

InChI=1S/C12H20O4S/c13-11(14)7-3-1-5-10(9-17)6-2-4-8-12(15)16/h1,5,10,17H,2-4,6-9H2,(H,13,14)(H,15,16)/b5-1+