(4-tert-butylphenyl) 6-oxidanylidene-3,4-diphenyl-1H-pyridazine-5-carboxylate

Systemtic Name: (4-tert-butylphenyl) 6-oxidanylidene-3,4-diphenyl-1H-pyridazine-5-carboxylate Openeye Name: (4-tert-butylphenyl) 6-oxo-3,4-diphenyl-1H-pyridazine-5-carboxylate CAS Name: 6-oxo-3,4-diphenyl-1H-pyridazine-5-carboxylic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) 6-oxo-3,4-diphenyl-1H-pyridazine-5-carboxylate Traditional Name: 6-keto-3,4-diphenyl-1H-pyridazine-5-carboxylic acid (4-tert-butylphenyl) ester Formula: C27H24N2O3 MolecularWeight: 424.49106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=C(C(=NNC2=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC(=O)C2=C(C(=NNC2=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H24N2O3/c1-27(2,3)20-14-16-21(17-15-20)32-26(31)23-22(18-10-6-4-7-11-18)24(28-29-25(23)30)19-12-8-5-9-13-19/h4-17H,1-3H3,(H,29,30)