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

Systemtic Name: N-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(1,2-oxazol-3-ylmethyl)pyridin-1-ium-2-amine Openeye Name: N-(isoxazol-3-ylmethyl)-N-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-amine CAS Name: N-(3-isoxazolylmethyl)-N-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridin-1-iumamine IUPAC Name: N-methyl-5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(1,2-oxazol-3-ylmethyl)pyridin-1-ium-2-amine Traditional Name: isoxazol-3-ylmethyl-methyl-[5-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]amine Formula: C13H14N5O2+ MolecularWeight: 272.28256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C2=C[NH+]=C(C=C2)N(C)CC3=NOC=C3

Isomeric SMILES

CC1=NOC(=N1)C2=C[NH+]=C(C=C2)N(C)CC3=NOC=C3

InChI

InChI=1S/C13H13N5O2/c1-9-15-13(20-16-9)10-3-4-12(14-7-10)18(2)8-11-5-6-19-17-11/h3-7H,8H2,1-2H3/p+1