5-chloranyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1H-indole-2-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-chloro-1H-indole-2-carboxamide CAS Name: 5-chloro-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-1H-indole-2-carboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-chloro-1H-indole-2-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-chloro-1H-indole-2-carboxamide Formula: C21H23ClN3O+ MolecularWeight: 368.87982

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC3=C(N2)C=CC(=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C21H22ClN3O/c22-17-6-7-19-16(12-17)13-20(24-19)21(26)23-18-8-10-25(11-9-18)14-15-4-2-1-3-5-15/h1-7,12-13,18,24H,8-11,14H2,(H,23,26)/p+1