2-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-sulfanyl-propanoic acid Openeye Name: 2-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-sulfanyl-propanoic acid CAS Name: 2-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-mercaptopropanoic acid IUPAC Name: 2-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-sulfanylpropanoic acid Traditional Name: 2-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-3-mercapto-propionic acid Formula: C13H23NO2S MolecularWeight: 257.39222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H23NO2S/c1-10(2)5-4-6-11(3)7-8-14-12(9-17)13(15)16/h5,7,12,14,17H,4,6,8-9H2,1-3H3,(H,15,16)/b11-7+