(Z)-N-(2-oxidanylidenepyrazolidin-2-ium-1-yl)-3-phenyl-but-2-enamide

Systemtic Name: (Z)-N-(2-oxidanylidenepyrazolidin-2-ium-1-yl)-3-phenyl-but-2-enamide Openeye Name: (Z)-N-(2-oxopyrazolidin-2-ium-1-yl)-3-phenyl-but-2-enamide CAS Name: (Z)-N-(2-oxo-1-pyrazolidin-2-iumyl)-3-phenyl-2-butenamide IUPAC Name: (Z)-N-(2-oxopyrazolidin-2-ium-1-yl)-3-phenylbut-2-enamide Traditional Name: (Z)-N-(2-ketopyrazolidin-2-ium-1-yl)-3-phenyl-but-2-enamide Formula: C13H16N3O2+ MolecularWeight: 246.28504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NN1CCC[N+]1=O)C2=CC=CC=C2

Isomeric SMILES

C/C(=C/C(=O)NN1CCC[N+]1=O)/C2=CC=CC=C2

InChI

InChI=1S/C13H15N3O2/c1-11(12-6-3-2-4-7-12)10-13(17)14-15-8-5-9-16(15)18/h2-4,6-7,10H,5,8-9H2,1H3/p+1/b11-10-