2-[[(1-hexadecylpyridin-1-ium-2-yl)disulfanyl]amino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[[(1-hexadecylpyridin-1-ium-2-yl)disulfanyl]amino]-3-sulfanyl-propanoic acid Openeye Name: 2-[[(1-hexadecylpyridin-1-ium-2-yl)disulfanyl]amino]-3-sulfanyl-propanoic acid CAS Name: 2-[[(1-hexadecyl-2-pyridin-1-iumyl)disulfanyl]amino]-3-mercaptopropanoic acid IUPAC Name: 2-[[(1-hexadecylpyridin-1-ium-2-yl)disulfanyl]amino]-3-sulfanylpropanoic acid Traditional Name: 2-[[(1-cetylpyridin-1-ium-2-yl)disulfanyl]amino]-3-mercapto-propionic acid Formula: C24H43N2O2S3+ MolecularWeight: 487.80542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1SSNC(CS)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1SSNC(CS)C(=O)O

InChI

InChI=1S/C24H42N2O2S3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-26-20-17-15-18-23(26)30-31-25-22(21-29)24(27)28/h15,17-18,20,22,25H,2-14,16,19,21H2,1H3,(H-,27,28,29)/p+1