3-(5-ethyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-1-phenyl-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione

Systemtic Name: 3-(5-ethyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)-1-phenyl-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione Openeye Name: 3-(5-ethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-1-phenyl-4-pyridin-1-ium-1-yl-pyrrole-2,5-dione CAS Name: 3-(5-ethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-1-phenyl-4-(1-pyridin-1-iumyl)pyrrole-2,5-dione IUPAC Name: 3-(5-ethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-1-phenyl-4-pyridin-1-ium-1-ylpyrrole-2,5-dione Traditional Name: 3-(3-ethyl-5-keto-1-phenyl-3-pyrazolin-4-yl)-1-phenyl-4-pyridin-1-ium-1-yl-3-pyrroline-2,5-quinone Formula: C26H21N4O3+ MolecularWeight: 437.46994

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N(N1)C2=CC=CC=C2)C3=C(C(=O)N(C3=O)C4=CC=CC=C4)[N+]5=CC=CC=C5

Isomeric SMILES

CCC1=C(C(=O)N(N1)C2=CC=CC=C2)C3=C(C(=O)N(C3=O)C4=CC=CC=C4)[N+]5=CC=CC=C5

InChI

InChI=1S/C26H20N4O3/c1-2-20-21(25(32)30(27-20)19-14-8-4-9-15-19)22-23(28-16-10-5-11-17-28)26(33)29(24(22)31)18-12-6-3-7-13-18/h3-17H,2H2,1H3/p+1