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

Systemtic Name: 5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-N-[(3-methylpyridin-4-yl)methyl]pyridin-1-ium-2-amine Openeye Name: 5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-N-[(3-methyl-4-pyridyl)methyl]pyridin-1-ium-2-amine CAS Name: 5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-N-[(3-methyl-4-pyridinyl)methyl]-2-pyridin-1-iumamine IUPAC Name: 5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-N-[(3-methylpyridin-4-yl)methyl]pyridin-1-ium-2-amine Traditional Name: [5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]-[(3-methyl-4-pyridyl)methyl]amine Formula: C16H18N5O2+ MolecularWeight: 312.34642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)CNC2=[NH+]C=C(C=C2)C3=NC(=NO3)COC

Isomeric SMILES

CC1=C(C=CN=C1)CNC2=[NH+]C=C(C=C2)C3=NC(=NO3)COC

InChI

InChI=1S/C16H17N5O2/c1-11-7-17-6-5-12(11)8-18-14-4-3-13(9-19-14)16-20-15(10-22-2)21-23-16/h3-7,9H,8,10H2,1-2H3,(H,18,19)/p+1