2-methyl-N-(2-oxidanylidene-1-phenyl-pyrazolidin-2-ium-3-yl)prop-2-enamide

Systemtic Name: 2-methyl-N-(2-oxidanylidene-1-phenyl-pyrazolidin-2-ium-3-yl)prop-2-enamide Openeye Name: 2-methyl-N-(2-oxo-1-phenyl-pyrazolidin-2-ium-3-yl)prop-2-enamide CAS Name: 2-methyl-N-(2-oxo-1-phenyl-3-pyrazolidin-2-iumyl)-2-propenamide IUPAC Name: 2-methyl-N-(2-oxo-1-phenylpyrazolidin-2-ium-3-yl)prop-2-enamide Traditional Name: N-(2-keto-1-phenyl-pyrazolidin-2-ium-3-yl)-2-methyl-acrylamide Formula: C13H16N3O2+ MolecularWeight: 246.28504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)NC1CCN([N+]1=O)C2=CC=CC=C2

Isomeric SMILES

CC(=C)C(=O)NC1CCN([N+]1=O)C2=CC=CC=C2

InChI

InChI=1S/C13H15N3O2/c1-10(2)13(17)14-12-8-9-15(16(12)18)11-6-4-3-5-7-11/h3-7,12H,1,8-9H2,2H3/p+1