4-[1-(2,4-dimethylphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]-1-(3-methylphenyl)-3-(3-methylpyridin-1-ium-1-yl)-5-oxidanylidene-pyrrol-2-olate

Systemtic Name: 4-[1-(2,4-dimethylphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]-1-(3-methylphenyl)-3-(3-methylpyridin-1-ium-1-yl)-5-oxidanylidene-pyrrol-2-olate Openeye Name: 4-[1-(2,4-dimethylphenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]-3-(3-methylpyridin-1-ium-1-yl)-1-(m-tolyl)-5-oxo-pyrrol-2-olate CAS Name: 4-[1-(2,4-dimethylphenyl)-3-methyl-5-oxo-4-pyrazolylidene]-1-(3-methylphenyl)-3-(3-methyl-1-pyridin-1-iumyl)-5-oxo-2-pyrrololate IUPAC Name: 4-[1-(2,4-dimethylphenyl)-3-methyl-5-oxopyrazol-4-ylidene]-1-(3-methylphenyl)-3-(3-methylpyridin-1-ium-1-yl)-5-oxopyrrol-2-olate Traditional Name: 4-[1-(2,4-dimethylphenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]-5-keto-3-(3-methylpyridin-1-ium-1-yl)-1-(m-tolyl)-2-pyrrolin-2-olate Formula: C29H26N4O3 MolecularWeight: 478.54174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H26N4O3/c1-17-8-6-10-22(15-17)32-27(34)25(26(29(32)36)31-13-7-9-19(3)16-31)24-21(5)30-33(28(24)35)23-12-11-18(2)14-20(23)4/h6-16H,1-5H3