(4E)-3-(3,4-dimethylpyridin-1-ium-1-yl)-4-(1-methyl-5-oxidanylidene-3-phenyl-pyrazol-4-ylidene)-1-(3-methylphenyl)-5-oxidanylidene-pyrrol-2-olate

Systemtic Name: (4E)-3-(3,4-dimethylpyridin-1-ium-1-yl)-4-(1-methyl-5-oxidanylidene-3-phenyl-pyrazol-4-ylidene)-1-(3-methylphenyl)-5-oxidanylidene-pyrrol-2-olate Openeye Name: (4E)-3-(3,4-dimethylpyridin-1-ium-1-yl)-4-(1-methyl-5-oxo-3-phenyl-pyrazol-4-ylidene)-1-(m-tolyl)-5-oxo-pyrrol-2-olate CAS Name: (4E)-3-(3,4-dimethyl-1-pyridin-1-iumyl)-4-(1-methyl-5-oxo-3-phenyl-4-pyrazolylidene)-1-(3-methylphenyl)-5-oxo-2-pyrrololate IUPAC Name: (4E)-3-(3,4-dimethylpyridin-1-ium-1-yl)-4-(1-methyl-5-oxo-3-phenylpyrazol-4-ylidene)-1-(3-methylphenyl)-5-oxopyrrol-2-olate Traditional Name: (4E)-3-(3,4-dimethylpyridin-1-ium-1-yl)-5-keto-4-(5-keto-1-methyl-3-phenyl-2-pyrazolin-4-ylidene)-1-(m-tolyl)-2-pyrrolin-2-olate Formula: C28H24N4O3 MolecularWeight: 464.51516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C(=C3C(=NN(C3=O)C)C4=CC=CC=C4)C2=O)[N+]5=CC(=C(C=C5)C)C)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(/C(=C\3/C(=NN(C3=O)C)C4=CC=CC=C4)/C2=O)[N+]5=CC(=C(C=C5)C)C)[O-]

InChI

InChI=1S/C28H24N4O3/c1-17-9-8-12-21(15-17)32-27(34)23(25(28(32)35)31-14-13-18(2)19(3)16-31)22-24(29-30(4)26(22)33)20-10-6-5-7-11-20/h5-16H,1-4H3