N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indazole-3-carboxamide

Systemtic Name: N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indazole-3-carboxamide Openeye Name: N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indazole-3-carboxamide CAS Name: N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]-1H-indazole-3-carboxamide IUPAC Name: N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-1H-indazole-3-carboxamide Traditional Name: N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]-1H-indazole-3-carboxamide Formula: C21H25N4O+ MolecularWeight: 349.4494

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=NNC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=NNC4=CC=CC=C43

InChI

InChI=1S/C21H24N4O/c26-21(20-18-10-4-5-11-19(18)23-24-20)22-14-16-8-2-3-9-17(16)15-25-12-6-1-7-13-25/h2-5,8-11H,1,6-7,12-15H2,(H,22,26)(H,23,24)/p+1