N-[(4R,5R)-3-oxidanylidene-5-phenyl-1-propan-2-ylidene-pyrazolidin-1-ium-4-yl]benzamide

Systemtic Name: N-[(4R,5R)-3-oxidanylidene-5-phenyl-1-propan-2-ylidene-pyrazolidin-1-ium-4-yl]benzamide Openeye Name: N-[(4R,5R)-1-isopropylidene-3-oxo-5-phenyl-pyrazolidin-1-ium-4-yl]benzamide CAS Name: N-[(4R,5R)-3-oxo-5-phenyl-1-propan-2-ylidene-4-pyrazolidin-1-iumyl]benzamide IUPAC Name: N-[(4R,5R)-3-oxo-5-phenyl-1-propan-2-ylidenepyrazolidin-1-ium-4-yl]benzamide Traditional Name: N-[(4R,5R)-1-isopropylidene-3-keto-5-phenyl-pyrazolidin-1-ium-4-yl]benzamide Formula: C19H20N3O2+ MolecularWeight: 322.381

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[N+]1C(C(C(=O)N1)NC(=O)C2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CC(=[N+]1[C@@H]([C@H](C(=O)N1)NC(=O)C2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C19H19N3O2/c1-13(2)22-17(14-9-5-3-6-10-14)16(19(24)21-22)20-18(23)15-11-7-4-8-12-15/h3-12,16-17H,1-2H3,(H-,20,21,23,24)/p+1/t16-,17-/m1/s1