1-methoxy-2-[5-(3-sulfosulfanylpropylamino)pentyl]benzene

Systemtic Name: 1-methoxy-2-[5-(3-sulfosulfanylpropylamino)pentyl]benzene Openeye Name: 1-methoxy-2-[5-(3-sulfosulfanylpropylamino)pentyl]benzene CAS Name: 1-methoxy-2-[5-[3-(sulfothio)propylamino]pentyl]benzene IUPAC Name: 1-methoxy-2-[5-(3-sulfosulfanylpropylamino)pentyl]benzene Traditional Name: 1-methoxy-2-[5-[3-(sulfothio)propylamino]pentyl]benzene Formula: C15H25NO4S2 MolecularWeight: 347.4933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCCCCNCCCSS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC=C1CCCCCNCCCSS(=O)(=O)O

InChI

InChI=1S/C15H25NO4S2/c1-20-15-10-5-4-9-14(15)8-3-2-6-11-16-12-7-13-21-22(17,18)19/h4-5,9-10,16H,2-3,6-8,11-13H2,1H3,(H,17,18,19)