1,3-dimethyl-2-[4-(2-sulfosulfanylethylamino)butoxy]benzene

Systemtic Name: 1,3-dimethyl-2-[4-(2-sulfosulfanylethylamino)butoxy]benzene Openeye Name: 1,3-dimethyl-2-[4-(2-sulfosulfanylethylamino)butoxy]benzene CAS Name: 1,3-dimethyl-2-[4-[2-(sulfothio)ethylamino]butoxy]benzene IUPAC Name: 1,3-dimethyl-2-[4-(2-sulfosulfanylethylamino)butoxy]benzene Traditional Name: 1,3-dimethyl-2-[4-[2-(sulfothio)ethylamino]butoxy]benzene Formula: C14H23NO4S2 MolecularWeight: 333.46672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCCCNCCSS(=O)(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCCCNCCSS(=O)(=O)O

InChI

InChI=1S/C14H23NO4S2/c1-12-6-5-7-13(2)14(12)19-10-4-3-8-15-9-11-20-21(16,17)18/h5-7,15H,3-4,8-11H2,1-2H3,(H,16,17,18)