2-[2-(azocan-1-yl)-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-(azocan-1-yl)-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(azocan-1-yl)-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-(1-azocanyl)-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-(azocan-1-yl)-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-(azocan-1-yl)-2-keto-ethyl]thio]acetic acid Formula: C11H19NO3S MolecularWeight: 245.33846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)CSCC(=O)O

Isomeric SMILES

C1CCCN(CCC1)C(=O)CSCC(=O)O

InChI

InChI=1S/C11H19NO3S/c13-10(8-16-9-11(14)15)12-6-4-2-1-3-5-7-12/h1-9H2,(H,14,15)