2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide

Systemtic Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide Openeye Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)acetamide CAS Name: 2-[(2S,6S)-2,6-dimethyl-4-morpholin-4-iumyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)acetamide IUPAC Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide Traditional Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acetamide Formula: C19H27N4O3+ MolecularWeight: 359.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

C[C@H]1C[NH+](C[C@@H](O1)C)CC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C19H26N4O3/c1-13-10-22(11-14(2)26-13)12-17(24)20-18-15(3)21(4)23(19(18)25)16-8-6-5-7-9-16/h5-9,13-14H,10-12H2,1-4H3,(H,20,24)/p+1/t13-,14-/m0/s1