1-phenyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]-1,2,3,4-tetrazol-5-amine

Systemtic Name: 1-phenyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]-1,2,3,4-tetrazol-5-amine Openeye Name: 1-phenyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]tetrazol-5-amine CAS Name: 1-phenyl-N-[[2-(1-pyrrolidinyl)-4-pyridin-1-iumyl]methyl]-5-tetrazolamine IUPAC Name: 1-phenyl-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]tetrazol-5-amine Traditional Name: (1-phenyltetrazol-5-yl)-[(2-pyrrolidinopyridin-1-ium-4-yl)methyl]amine Formula: C17H20N7+ MolecularWeight: 322.3876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C17H19N7/c1-2-6-15(7-3-1)24-17(20-21-22-24)19-13-14-8-9-18-16(12-14)23-10-4-5-11-23/h1-3,6-9,12H,4-5,10-11,13H2,(H,19,20,22)/p+1