4-(2-sulfosulfanylethylamino)butylbenzene

Systemtic Name: 4-(2-sulfosulfanylethylamino)butylbenzene Openeye Name: 4-(2-sulfosulfanylethylamino)butylbenzene CAS Name: 4-[2-(sulfothio)ethylamino]butylbenzene IUPAC Name: 4-(2-sulfosulfanylethylamino)butylbenzene Traditional Name: 4-[2-(sulfothio)ethylamino]butylbenzene Formula: C12H19NO3S2 MolecularWeight: 289.41416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCNCCSS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCNCCSS(=O)(=O)O

InChI

InChI=1S/C12H19NO3S2/c14-18(15,16)17-11-10-13-9-5-4-8-12-6-2-1-3-7-12/h1-3,6-7,13H,4-5,8-11H2,(H,14,15,16)