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

Systemtic Name: 5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyridin-2-ylbutyl)pyridin-1-ium-2-amine Openeye Name: 5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[4-(2-pyridyl)butyl]pyridin-1-ium-2-amine CAS Name: 5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-[4-(2-pyridinyl)butyl]-2-pyridin-1-iumamine IUPAC Name: 5-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyridin-2-ylbutyl)pyridin-1-ium-2-amine Traditional Name: [5-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-[4-(2-pyridyl)butyl]amine Formula: C17H20N5O+ MolecularWeight: 310.3736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C2=C[NH+]=C(C=C2)NCCCCC3=CC=CC=N3

Isomeric SMILES

CC1=NOC(=N1)C2=C[NH+]=C(C=C2)NCCCCC3=CC=CC=N3

InChI

InChI=1S/C17H19N5O/c1-13-21-17(23-22-13)14-8-9-16(20-12-14)19-11-5-3-7-15-6-2-4-10-18-15/h2,4,6,8-10,12H,3,5,7,11H2,1H3,(H,19,20)/p+1