N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]-3-pyrrolidin-1-ium-1-yl-propan-1-amine

Systemtic Name: N-[(2-phenyl-1,2,3-triazol-4-yl)methyl]-3-pyrrolidin-1-ium-1-yl-propan-1-amine Openeye Name: N-[(2-phenyltriazol-4-yl)methyl]-3-pyrrolidin-1-ium-1-yl-propan-1-amine CAS Name: N-[(2-phenyl-4-triazolyl)methyl]-3-(1-pyrrolidin-1-iumyl)-1-propanamine IUPAC Name: N-[(2-phenyltriazol-4-yl)methyl]-3-pyrrolidin-1-ium-1-ylpropan-1-amine Traditional Name: (2-phenyltriazol-4-yl)methyl-(3-pyrrolidin-1-ium-1-ylpropyl)amine Formula: C16H24N5+ MolecularWeight: 286.39526

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCNCC2=NN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)CCCNCC2=NN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H23N5/c1-2-7-16(8-3-1)21-18-14-15(19-21)13-17-9-6-12-20-10-4-5-11-20/h1-3,7-8,14,17H,4-6,9-13H2/p+1