3-(1-butyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)-5-chloranyl-1H-indole chloride

Systemtic Name: 3-(1-butyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)-5-chloranyl-1H-indole chloride Openeye Name: 3-(1-butyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)-5-chloro-1H-indole chloride CAS Name: 3-(1-butyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)-5-chloro-1H-indole chloride IUPAC Name: 3-(1-butyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)-5-chloro-1H-indole chloride Traditional Name: 3-(1-butyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)-5-chloro-1H-indole chloride Formula: C17H22Cl2N2 MolecularWeight: 325.27598

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+]1CCC(=CC1)C2=CNC3=C2C=C(C=C3)Cl.[Cl-]

Isomeric SMILES

CCCC[NH+]1CCC(=CC1)C2=CNC3=C2C=C(C=C3)Cl.[Cl-]

InChI

InChI=1S/C17H21ClN2.ClH/c1-2-3-8-20-9-6-13(7-10-20)16-12-19-17-5-4-14(18)11-15(16)17;/h4-6,11-12,19H,2-3,7-10H2,1H3;1H