1-methyl-2-[5-(2-sulfosulfanylethylamino)pentoxy]benzene

Systemtic Name: 1-methyl-2-[5-(2-sulfosulfanylethylamino)pentoxy]benzene Openeye Name: 1-methyl-2-[5-(2-sulfosulfanylethylamino)pentoxy]benzene CAS Name: 1-methyl-2-[5-[2-(sulfothio)ethylamino]pentoxy]benzene IUPAC Name: 1-methyl-2-[5-(2-sulfosulfanylethylamino)pentoxy]benzene Traditional Name: 1-methyl-2-[5-[2-(sulfothio)ethylamino]pentoxy]benzene Formula: C14H23NO4S2 MolecularWeight: 333.46672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCCCCNCCSS(=O)(=O)O

Isomeric SMILES

CC1=CC=CC=C1OCCCCCNCCSS(=O)(=O)O

InChI

InChI=1S/C14H23NO4S2/c1-13-7-3-4-8-14(13)19-11-6-2-5-9-15-10-12-20-21(16,17)18/h3-4,7-8,15H,2,5-6,9-12H2,1H3,(H,16,17,18)