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

Systemtic Name: N,N-dimethyl-2-(5-sulfanyl-4aH-pyrano[4,3-b]indol-5-ium-5-yl)ethanamine Openeye Name: N,N-dimethyl-2-(5-sulfanyl-4aH-pyrano[4,3-b]indol-5-ium-5-yl)ethanamine CAS Name: 2-(5-mercapto-4aH-pyrano[4,3-b]indol-5-ium-5-yl)-N,N-dimethylethanamine IUPAC Name: N,N-dimethyl-2-(5-sulfanyl-4aH-pyrano[4,3-b]indol-5-ium-5-yl)ethanamine Traditional Name: 2-(5-mercapto-4aH-pyran[4,3-b]indol-5-ium-5-yl)ethyl-dimethyl-amine Formula: C15H19N2OS+ MolecularWeight: 275.38916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N2OS/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/q+1