N-(2-hydroxyethyl)-N-methyl-1-[1-[(4-phenylphenyl)methyl]piperidin-1-ium-4-yl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-hydroxyethyl)-N-methyl-1-[1-[(4-phenylphenyl)methyl]piperidin-1-ium-4-yl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-hydroxyethyl)-N-methyl-1-[1-[(4-phenylphenyl)methyl]piperidin-1-ium-4-yl]triazole-4-carboxamide CAS Name: N-(2-hydroxyethyl)-N-methyl-1-[1-[(4-phenylphenyl)methyl]-4-piperidin-1-iumyl]-4-triazolecarboxamide IUPAC Name: N-(2-hydroxyethyl)-N-methyl-1-[1-[(4-phenylphenyl)methyl]piperidin-1-ium-4-yl]triazole-4-carboxamide Traditional Name: N-(2-hydroxyethyl)-N-methyl-1-[1-(4-phenylbenzyl)piperidin-1-ium-4-yl]triazole-4-carboxamide Formula: C24H30N5O2+ MolecularWeight: 420.5273

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCO)C(=O)C1=CN(N=N1)C2CC[NH+](CC2)CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CCO)C(=O)C1=CN(N=N1)C2CC[NH+](CC2)CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H29N5O2/c1-27(15-16-30)24(31)23-18-29(26-25-23)22-11-13-28(14-12-22)17-19-7-9-21(10-8-19)20-5-3-2-4-6-20/h2-10,18,22,30H,11-17H2,1H3/p+1