3-(4-methylpyridin-1-ium-1-yl)-5-oxidanylidene-4-(5-oxidanylidene-1-phenyl-3-propan-2-yl-pyrazol-4-ylidene)-1-phenyl-pyrrol-2-olate

Systemtic Name: 3-(4-methylpyridin-1-ium-1-yl)-5-oxidanylidene-4-(5-oxidanylidene-1-phenyl-3-propan-2-yl-pyrazol-4-ylidene)-1-phenyl-pyrrol-2-olate Openeye Name: 4-(3-isopropyl-5-oxo-1-phenyl-pyrazol-4-ylidene)-3-(4-methylpyridin-1-ium-1-yl)-5-oxo-1-phenyl-pyrrol-2-olate CAS Name: 3-(4-methyl-1-pyridin-1-iumyl)-5-oxo-4-(5-oxo-1-phenyl-3-propan-2-yl-4-pyrazolylidene)-1-phenyl-2-pyrrololate IUPAC Name: 3-(4-methylpyridin-1-ium-1-yl)-5-oxo-4-(5-oxo-1-phenyl-3-propan-2-ylpyrazol-4-ylidene)-1-phenylpyrrol-2-olate Traditional Name: 4-(3-isopropyl-5-keto-1-phenyl-2-pyrazolin-4-ylidene)-5-keto-3-(4-methylpyridin-1-ium-1-yl)-1-phenyl-2-pyrrolin-2-olate Formula: C28H24N4O3 MolecularWeight: 464.51516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)C2=C(N(C(=O)C2=C3C(=NN(C3=O)C4=CC=CC=C4)C(C)C)C5=CC=CC=C5)[O-]

Isomeric SMILES

CC1=CC=[N+](C=C1)C2=C(N(C(=O)C2=C3C(=NN(C3=O)C4=CC=CC=C4)C(C)C)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C28H24N4O3/c1-18(2)24-22(27(34)32(29-24)21-12-8-5-9-13-21)23-25(30-16-14-19(3)15-17-30)28(35)31(26(23)33)20-10-6-4-7-11-20/h4-18H,1-3H3