1-phenethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-phenethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-phenethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)triazole-4-carboxamide CAS Name: 1-phenethyl-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-4-triazolecarboxamide IUPAC Name: 1-phenethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)triazole-4-carboxamide Traditional Name: 1-phenethyl-N-(2-pyrrolidin-1-ium-1-ylethyl)triazole-4-carboxamide Formula: C17H24N5O+ MolecularWeight: 314.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNC(=O)C2=CN(N=N2)CCC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)CCNC(=O)C2=CN(N=N2)CCC3=CC=CC=C3

InChI

InChI=1S/C17H23N5O/c23-17(18-9-13-21-10-4-5-11-21)16-14-22(20-19-16)12-8-15-6-2-1-3-7-15/h1-3,6-7,14H,4-5,8-13H2,(H,18,23)/p+1