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

Systemtic Name: 5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-N-[(3-pyridin-3-yl-1,2-oxazol-5-yl)methyl]pyridin-1-ium-2-amine Openeye Name: 5-(3-isopropyl-1,2,4-oxadiazol-5-yl)-N-[[3-(3-pyridyl)isoxazol-5-yl]methyl]pyridin-1-ium-2-amine CAS Name: 5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-N-[[3-(3-pyridinyl)-5-isoxazolyl]methyl]-2-pyridin-1-iumamine IUPAC Name: 5-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)-N-[(3-pyridin-3-yl-1,2-oxazol-5-yl)methyl]pyridin-1-ium-2-amine Traditional Name: [5-(3-isopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-[[3-(3-pyridyl)isoxazol-5-yl]methyl]amine Formula: C19H19N6O2+ MolecularWeight: 363.39316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)C2=C[NH+]=C(C=C2)NCC3=CC(=NO3)C4=CN=CC=C4

Isomeric SMILES

CC(C)C1=NOC(=N1)C2=C[NH+]=C(C=C2)NCC3=CC(=NO3)C4=CN=CC=C4

InChI

InChI=1S/C19H18N6O2/c1-12(2)18-23-19(27-25-18)14-5-6-17(21-10-14)22-11-15-8-16(24-26-15)13-4-3-7-20-9-13/h3-10,12H,11H2,1-2H3,(H,21,22)/p+1