tert-butyl 6-oxidanylidene-3,4-diphenyl-1H-pyridazine-5-carboxylate

Systemtic Name: tert-butyl 6-oxidanylidene-3,4-diphenyl-1H-pyridazine-5-carboxylate Openeye Name: tert-butyl 6-oxo-3,4-diphenyl-1H-pyridazine-5-carboxylate CAS Name: 6-oxo-3,4-diphenyl-1H-pyridazine-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-oxo-3,4-diphenyl-1H-pyridazine-5-carboxylate Traditional Name: 6-keto-3,4-diphenyl-1H-pyridazine-5-carboxylic acid tert-butyl ester Formula: C21H20N2O3 MolecularWeight: 348.3951

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C(=NNC1=O)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C(=NNC1=O)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3/c1-21(2,3)26-20(25)17-16(14-10-6-4-7-11-14)18(22-23-19(17)24)15-12-8-5-9-13-15/h4-13H,1-3H3,(H,23,24)