4-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]-1,4-oxazepane

Systemtic Name: 4-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]-1,4-oxazepane Openeye Name: 4-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]-1,4-oxazepane CAS Name: 4-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridin-1-iumyl]-1,4-oxazepane IUPAC Name: 4-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]-1,4-oxazepane Traditional Name: 4-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]-1,4-oxazepane Formula: C14H19N4O3+ MolecularWeight: 291.32566

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NOC(=N1)C2=C[NH+]=C(C=C2)N3CCCOCC3

Isomeric SMILES

COCC1=NOC(=N1)C2=C[NH+]=C(C=C2)N3CCCOCC3

InChI

InChI=1S/C14H18N4O3/c1-19-10-12-16-14(21-17-12)11-3-4-13(15-9-11)18-5-2-7-20-8-6-18/h3-4,9H,2,5-8,10H2,1H3/p+1