5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(pyridin-4-ylmethyl)pyridin-1-ium-2-amine

Systemtic Name: 5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(pyridin-4-ylmethyl)pyridin-1-ium-2-amine Openeye Name: 5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyridylmethyl)pyridin-1-ium-2-amine CAS Name: 5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(pyridin-4-ylmethyl)-2-pyridin-1-iumamine IUPAC Name: 5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(pyridin-4-ylmethyl)pyridin-1-ium-2-amine Traditional Name: [5-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-(4-pyridylmethyl)amine Formula: C14H14N5O+ MolecularWeight: 268.29386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C2=C[NH+]=C(C=C2)NCC3=CC=NC=C3

Isomeric SMILES

CC1=NOC(=N1)C2=C[NH+]=C(C=C2)NCC3=CC=NC=C3

InChI

InChI=1S/C14H13N5O/c1-10-18-14(20-19-10)12-2-3-13(17-9-12)16-8-11-4-6-15-7-5-11/h2-7,9H,8H2,1H3,(H,16,17)/p+1