N,N-dimethyl-2-(5-sulfanyl-4aH-pyrano[4,3-b]indol-5-ium-5-yl)ethanamine hydrochloride

Systemtic Name: N,N-dimethyl-2-(5-sulfanyl-4aH-pyrano[4,3-b]indol-5-ium-5-yl)ethanamine hydrochloride Openeye Name: N,N-dimethyl-2-(5-sulfanyl-4aH-pyrano[4,3-b]indol-5-ium-5-yl)ethanamine hydrochloride CAS Name: 2-(5-mercapto-4aH-pyrano[4,3-b]indol-5-ium-5-yl)-N,N-dimethylethanamine hydrochloride IUPAC Name: N,N-dimethyl-2-(5-sulfanyl-4aH-pyrano[4,3-b]indol-5-ium-5-yl)ethanamine hydrochloride Traditional Name: 2-(5-mercapto-4aH-pyran[4,3-b]indol-5-ium-5-yl)ethyl-dimethyl-amine hydrochloride Formula: C15H20ClN2OS+ MolecularWeight: 311.8501

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC[N+]1(C2C=COC=C2C3=CC=CC=C31)S.Cl

Isomeric SMILES

CN(C)CC[N+]1(C2C=COC=C2C3=CC=CC=C31)S.Cl

InChI

InChI=1S/C15H19N2OS.ClH/c1-16(2)8-9-17(19)14-6-4-3-5-12(14)13-11-18-10-7-15(13)17;/h3-7,10-11,15,19H,8-9H2,1-2H3;1H/q+1;