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

Systemtic Name: 4-[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-1,4-oxazepane Openeye Name: 4-[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-1,4-oxazepane CAS Name: 4-[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-pyridin-1-iumyl]-1,4-oxazepane IUPAC Name: 4-[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-1,4-oxazepane Traditional Name: 4-[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-1,4-oxazepane Formula: C15H19N4O2+ MolecularWeight: 287.33696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCOC1)C2=[NH+]C=C(C=C2)C3=NC(=NO3)C4CC4

Isomeric SMILES

C1CN(CCOC1)C2=[NH+]C=C(C=C2)C3=NC(=NO3)C4CC4

InChI

InChI=1S/C15H18N4O2/c1-6-19(7-9-20-8-1)13-5-4-12(10-16-13)15-17-14(18-21-15)11-2-3-11/h4-5,10-11H,1-3,6-9H2/p+1