N-methyl-5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]-N-(2-pyridin-2-ylethyl)pyridin-1-ium-2-amine

Systemtic Name: N-methyl-5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]-N-(2-pyridin-2-ylethyl)pyridin-1-ium-2-amine Openeye Name: N-methyl-5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]-N-[2-(2-pyridyl)ethyl]pyridin-1-ium-2-amine CAS Name: N-methyl-5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]-N-[2-(2-pyridinyl)ethyl]-2-pyridin-1-iumamine IUPAC Name: N-methyl-5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]-N-(2-pyridin-2-ylethyl)pyridin-1-ium-2-amine Traditional Name: methyl-[5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]-[2-(2-pyridyl)ethyl]amine Formula: C22H22N5O2+ MolecularWeight: 388.44238

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C2=[NH+]C=C(C=C2)C3=NC(=NO3)COC4=CC=CC=C4

Isomeric SMILES

CN(CCC1=CC=CC=N1)C2=[NH+]C=C(C=C2)C3=NC(=NO3)COC4=CC=CC=C4

InChI

InChI=1S/C22H21N5O2/c1-27(14-12-18-7-5-6-13-23-18)21-11-10-17(15-24-21)22-25-20(26-29-22)16-28-19-8-3-2-4-9-19/h2-11,13,15H,12,14,16H2,1H3/p+1