1-methoxy-2-[3-(2-sulfosulfanylethylamino)propyl]benzene

Systemtic Name: 1-methoxy-2-[3-(2-sulfosulfanylethylamino)propyl]benzene Openeye Name: 1-methoxy-2-[3-(2-sulfosulfanylethylamino)propyl]benzene CAS Name: 1-methoxy-2-[3-[2-(sulfothio)ethylamino]propyl]benzene IUPAC Name: 1-methoxy-2-[3-(2-sulfosulfanylethylamino)propyl]benzene Traditional Name: 1-methoxy-2-[3-[2-(sulfothio)ethylamino]propyl]benzene Formula: C12H19NO4S2 MolecularWeight: 305.41356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCCNCCSS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC=C1CCCNCCSS(=O)(=O)O

InChI

InChI=1S/C12H19NO4S2/c1-17-12-7-3-2-5-11(12)6-4-8-13-9-10-18-19(14,15)16/h2-3,5,7,13H,4,6,8-10H2,1H3,(H,14,15,16)