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

Systemtic Name: N-(1,2-oxazol-3-ylmethyl)-5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-amine Openeye Name: N-(isoxazol-3-ylmethyl)-5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-amine CAS Name: N-(3-isoxazolylmethyl)-5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridin-1-iumamine IUPAC Name: N-(1,2-oxazol-3-ylmethyl)-5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-amine Traditional Name: isoxazol-3-ylmethyl-[5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]amine Formula: C18H16N5O3+ MolecularWeight: 350.35134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=NOC(=N2)C3=C[NH+]=C(C=C3)NCC4=NOC=C4

Isomeric SMILES

C1=CC=C(C=C1)OCC2=NOC(=N2)C3=C[NH+]=C(C=C3)NCC4=NOC=C4

InChI

InChI=1S/C18H15N5O3/c1-2-4-15(5-3-1)24-12-17-21-18(26-23-17)13-6-7-16(19-10-13)20-11-14-8-9-25-22-14/h1-10H,11-12H2,(H,19,20)/p+1