3-[2-[2-(4-methylpentyl)morpholin-4-yl]-2-oxidanylidene-ethyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-[2-[2-(4-methylpentyl)morpholin-4-yl]-2-oxidanylidene-ethyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[2-(2-isohexylmorpholin-4-yl)-2-oxo-ethyl]oxadiazol-3-ium-5-olate CAS Name: 3-[2-[2-(4-methylpentyl)-4-morpholinyl]-2-oxoethyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[2-[2-(4-methylpentyl)morpholin-4-yl]-2-oxoethyl]oxadiazol-3-ium-5-olate Traditional Name: 3-[2-(2-isohexylmorpholino)-2-keto-ethyl]oxadiazol-3-ium-5-olate Formula: C14H23N3O4 MolecularWeight: 297.35012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC1CN(CCO1)C(=O)C[N+]2=NOC(=C2)[O-]

Isomeric SMILES

CC(C)CCCC1CN(CCO1)C(=O)C[N+]2=NOC(=C2)[O-]

InChI

InChI=1S/C14H23N3O4/c1-11(2)4-3-5-12-8-16(6-7-20-12)13(18)9-17-10-14(19)21-15-17/h10-12H,3-9H2,1-2H3