1-chloranyl-3-[1-(2-sulfosulfanylethylamino)butan-2-yloxy]benzene

Systemtic Name: 1-chloranyl-3-[1-(2-sulfosulfanylethylamino)butan-2-yloxy]benzene Openeye Name: 1-chloro-3-[1-[(2-sulfosulfanylethylamino)methyl]propoxy]benzene CAS Name: 1-chloro-3-[1-[2-(sulfothio)ethylamino]butan-2-yloxy]benzene IUPAC Name: 1-chloro-3-[1-(2-sulfosulfanylethylamino)butan-2-yloxy]benzene Traditional Name: 1-chloro-3-[1-[[2-(sulfothio)ethylamino]methyl]propoxy]benzene Formula: C12H18ClNO4S2 MolecularWeight: 339.85862

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNCCSS(=O)(=O)O)OC1=CC(=CC=C1)Cl

Isomeric SMILES

CCC(CNCCSS(=O)(=O)O)OC1=CC(=CC=C1)Cl

InChI

InChI=1S/C12H18ClNO4S2/c1-2-11(9-14-6-7-19-20(15,16)17)18-12-5-3-4-10(13)8-12/h3-5,8,11,14H,2,6-7,9H2,1H3,(H,15,16,17)