5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(1S)-1-(6-methylpyridin-3-yl)ethyl]pyridin-1-ium-2-amine

Systemtic Name: 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(1S)-1-(6-methylpyridin-3-yl)ethyl]pyridin-1-ium-2-amine Openeye Name: 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(1S)-1-(6-methyl-3-pyridyl)ethyl]pyridin-1-ium-2-amine CAS Name: 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(1S)-1-(6-methyl-3-pyridinyl)ethyl]-2-pyridin-1-iumamine IUPAC Name: 5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-N-[(1S)-1-(6-methylpyridin-3-yl)ethyl]pyridin-1-ium-2-amine Traditional Name: [5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-[(1S)-1-(6-methyl-3-pyridyl)ethyl]amine Formula: C18H20N5O+ MolecularWeight: 322.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(C)NC2=[NH+]C=C(C=C2)C3=NC(=NO3)C4CC4

Isomeric SMILES

CC1=NC=C(C=C1)[C@H](C)NC2=[NH+]C=C(C=C2)C3=NC(=NO3)C4CC4

InChI

InChI=1S/C18H19N5O/c1-11-3-4-14(9-19-11)12(2)21-16-8-7-15(10-20-16)18-22-17(23-24-18)13-5-6-13/h3-4,7-10,12-13H,5-6H2,1-2H3,(H,20,21)/p+1/t12-/m0/s1