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

Systemtic Name: 3-(3,4-dimethylpyridin-1-ium-1-yl)-1-(3-methylphenyl)-5-oxidanylidene-4-(5-oxidanylidene-1-phenyl-3-propan-2-yl-pyrazol-4-ylidene)pyrrol-2-olate Openeye Name: 3-(3,4-dimethylpyridin-1-ium-1-yl)-4-(3-isopropyl-5-oxo-1-phenyl-pyrazol-4-ylidene)-1-(m-tolyl)-5-oxo-pyrrol-2-olate CAS Name: 3-(3,4-dimethyl-1-pyridin-1-iumyl)-1-(3-methylphenyl)-5-oxo-4-(5-oxo-1-phenyl-3-propan-2-yl-4-pyrazolylidene)-2-pyrrololate IUPAC Name: 3-(3,4-dimethylpyridin-1-ium-1-yl)-1-(3-methylphenyl)-5-oxo-4-(5-oxo-1-phenyl-3-propan-2-ylpyrazol-4-ylidene)pyrrol-2-olate Traditional Name: 3-(3,4-dimethylpyridin-1-ium-1-yl)-4-(3-isopropyl-5-keto-1-phenyl-2-pyrazolin-4-ylidene)-5-keto-1-(m-tolyl)-2-pyrrolin-2-olate Formula: C30H28N4O3 MolecularWeight: 492.56832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H28N4O3/c1-18(2)26-24(29(36)34(31-26)22-11-7-6-8-12-22)25-27(32-15-14-20(4)21(5)17-32)30(37)33(28(25)35)23-13-9-10-19(3)16-23/h6-18H,1-5H3