1H-indol-3-yl-[4-[[4-(pyrrolidin-1-ium-1-ylmethyl)-1,2,3-triazol-1-yl]methyl]piperidin-1-yl]methanone

Systemtic Name: 1H-indol-3-yl-[4-[[4-(pyrrolidin-1-ium-1-ylmethyl)-1,2,3-triazol-1-yl]methyl]piperidin-1-yl]methanone Openeye Name: 1H-indol-3-yl-[4-[[4-(pyrrolidin-1-ium-1-ylmethyl)triazol-1-yl]methyl]-1-piperidyl]methanone CAS Name: 1H-indol-3-yl-[4-[[4-(1-pyrrolidin-1-iumylmethyl)-1-triazolyl]methyl]-1-piperidinyl]methanone IUPAC Name: 1H-indol-3-yl-[4-[[4-(pyrrolidin-1-ium-1-ylmethyl)triazol-1-yl]methyl]piperidin-1-yl]methanone Traditional Name: 1H-indol-3-yl-[4-[[4-(pyrrolidin-1-ium-1-ylmethyl)triazol-1-yl]methyl]piperidino]methanone Formula: C22H29N6O+ MolecularWeight: 393.50526

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CN(N=N2)CC3CCN(CC3)C(=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1CC[NH+](C1)CC2=CN(N=N2)CC3CCN(CC3)C(=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C22H28N6O/c29-22(20-13-23-21-6-2-1-5-19(20)21)27-11-7-17(8-12-27)14-28-16-18(24-25-28)15-26-9-3-4-10-26/h1-2,5-6,13,16-17,23H,3-4,7-12,14-15H2/p+1