(4E)-4-[1-(3-chlorophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]-1-cyclohexyl-3-(3-methylpyridin-1-ium-1-yl)-5-oxidanylidene-pyrrol-2-olate

Systemtic Name: (4E)-4-[1-(3-chlorophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]-1-cyclohexyl-3-(3-methylpyridin-1-ium-1-yl)-5-oxidanylidene-pyrrol-2-olate Openeye Name: (4E)-4-[1-(3-chlorophenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]-1-cyclohexyl-3-(3-methylpyridin-1-ium-1-yl)-5-oxo-pyrrol-2-olate CAS Name: (4E)-4-[1-(3-chlorophenyl)-3-methyl-5-oxo-4-pyrazolylidene]-1-cyclohexyl-3-(3-methyl-1-pyridin-1-iumyl)-5-oxo-2-pyrrololate IUPAC Name: (4E)-4-[1-(3-chlorophenyl)-3-methyl-5-oxopyrazol-4-ylidene]-1-cyclohexyl-3-(3-methylpyridin-1-ium-1-yl)-5-oxopyrrol-2-olate Traditional Name: (4E)-4-[1-(3-chlorophenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]-1-cyclohexyl-5-keto-3-(3-methylpyridin-1-ium-1-yl)-2-pyrrolin-2-olate Formula: C26H25ClN4O3 MolecularWeight: 476.9547

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C2=C(N(C(=O)C2=C3C(=NN(C3=O)C4=CC(=CC=C4)Cl)C)C5CCCCC5)[O-]

Isomeric SMILES

CC1=C[N+](=CC=C1)C\2=C(N(C(=O)/C2=C/3\C(=NN(C3=O)C4=CC(=CC=C4)Cl)C)C5CCCCC5)[O-]

InChI

InChI=1S/C26H25ClN4O3/c1-16-8-7-13-29(15-16)23-22(24(32)30(26(23)34)19-10-4-3-5-11-19)21-17(2)28-31(25(21)33)20-12-6-9-18(27)14-20/h6-9,12-15,19H,3-5,10-11H2,1-2H3