2-[1-[[1-(1-benzothiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]-1,2,3-triazol-4-yl]ethanol

Systemtic Name: 2-[1-[[1-(1-benzothiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]-1,2,3-triazol-4-yl]ethanol Openeye Name: 2-[1-[[1-(benzothiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]triazol-4-yl]ethanol CAS Name: 2-[1-[[1-(1-benzothiophen-2-ylmethyl)-4-piperidin-1-iumyl]methyl]-4-triazolyl]ethanol IUPAC Name: 2-[1-[[1-(1-benzothiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]triazol-4-yl]ethanol Traditional Name: 2-[1-[[1-(benzothiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]triazol-4-yl]ethanol Formula: C19H25N4OS+ MolecularWeight: 357.493

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CN2C=C(N=N2)CCO)CC3=CC4=CC=CC=C4S3

Isomeric SMILES

C1C[NH+](CCC1CN2C=C(N=N2)CCO)CC3=CC4=CC=CC=C4S3

InChI

InChI=1S/C19H24N4OS/c24-10-7-17-13-23(21-20-17)12-15-5-8-22(9-6-15)14-18-11-16-3-1-2-4-19(16)25-18/h1-4,11,13,15,24H,5-10,12,14H2/p+1