3-[2-oxidanylidene-2-[3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]ethyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-[2-oxidanylidene-2-[3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]ethyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[2-[3-(4-isopropylanilino)-1-piperidyl]-2-oxo-ethyl]oxadiazol-3-ium-5-olate CAS Name: 3-[2-oxo-2-[3-(4-propan-2-ylanilino)-1-piperidinyl]ethyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[2-oxo-2-[3-(4-propan-2-ylanilino)piperidin-1-yl]ethyl]oxadiazol-3-ium-5-olate Traditional Name: 3-[2-(3-cumidinopiperidino)-2-keto-ethyl]oxadiazol-3-ium-5-olate Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2CCCN(C2)C(=O)C[N+]3=NOC(=C3)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2CCCN(C2)C(=O)C[N+]3=NOC(=C3)[O-]

InChI

InChI=1S/C18H24N4O3/c1-13(2)14-5-7-15(8-6-14)19-16-4-3-9-21(10-16)17(23)11-22-12-18(24)25-20-22/h5-8,12-13,16,19H,3-4,9-11H2,1-2H3