2-azanyl-6-(1,3-benzodioxol-5-yloxy)hexane-1-thiol hydrochloride

Systemtic Name: 2-azanyl-6-(1,3-benzodioxol-5-yloxy)hexane-1-thiol hydrochloride Openeye Name: 2-amino-6-(1,3-benzodioxol-5-yloxy)hexane-1-thiol hydrochloride CAS Name: 2-amino-6-(1,3-benzodioxol-5-yloxy)-1-hexanethiol hydrochloride IUPAC Name: 2-amino-6-(1,3-benzodioxol-5-yloxy)hexane-1-thiol hydrochloride Traditional Name: 2-amino-6-(1,3-benzodioxol-5-yloxy)hexane-1-thiol hydrochloride Formula: C13H20ClNO3S MolecularWeight: 305.8208

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCCCCC(CS)N.Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCCCCC(CS)N.Cl

InChI

InChI=1S/C13H19NO3S.ClH/c14-10(8-18)3-1-2-6-15-11-4-5-12-13(7-11)17-9-16-12;/h4-5,7,10,18H,1-3,6,8-9,14H2;1H