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

Systemtic Name: 3-[2-oxidanylidene-2-[2-(3-phenylpropyl)morpholin-4-yl]ethyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[2-oxo-2-[2-(3-phenylpropyl)morpholin-4-yl]ethyl]oxadiazol-3-ium-5-olate CAS Name: 3-[2-oxo-2-[2-(3-phenylpropyl)-4-morpholinyl]ethyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[2-oxo-2-[2-(3-phenylpropyl)morpholin-4-yl]ethyl]oxadiazol-3-ium-5-olate Traditional Name: 3-[2-keto-2-[2-(3-phenylpropyl)morpholino]ethyl]oxadiazol-3-ium-5-olate Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C(=O)C[N+]2=NOC(=C2)[O-])CCCC3=CC=CC=C3

Isomeric SMILES

C1COC(CN1C(=O)C[N+]2=NOC(=C2)[O-])CCCC3=CC=CC=C3

InChI

InChI=1S/C17H21N3O4/c21-16(12-20-13-17(22)24-18-20)19-9-10-23-15(11-19)8-4-7-14-5-2-1-3-6-14/h1-3,5-6,13,15H,4,7-12H2