N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indole-2-carboxamide

Systemtic Name: N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indole-2-carboxamide Openeye Name: N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indole-2-carboxamide CAS Name: N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]-1H-indole-2-carboxamide IUPAC Name: N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indole-2-carboxamide Traditional Name: N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]-1H-indole-2-carboxamide Formula: C22H26N3O+ MolecularWeight: 348.46134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=CC4=CC=CC=C4N3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C22H25N3O/c26-22(21-14-19-6-2-3-7-20(19)24-21)23-15-17-8-10-18(11-9-17)16-25-12-4-1-5-13-25/h2-3,6-11,14,24H,1,4-5,12-13,15-16H2,(H,23,26)/p+1