[4-[(4-tert-butylphenyl)carbonylamino]phenyl] 6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxylate

Systemtic Name: [4-[(4-tert-butylphenyl)carbonylamino]phenyl] 6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxylate Openeye Name: [4-[(4-tert-butylbenzoyl)amino]phenyl] 1-benzyl-6-oxo-pyridazine-3-carboxylate CAS Name: 6-oxo-1-(phenylmethyl)-3-pyridazinecarboxylic acid [4-[[(4-tert-butylphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(4-tert-butylbenzoyl)amino]phenyl] 1-benzyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-benzyl-6-keto-pyridazine-3-carboxylic acid [4-[(4-tert-butylbenzoyl)amino]phenyl] ester Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)OC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)OC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C29H27N3O4/c1-29(2,3)22-11-9-21(10-12-22)27(34)30-23-13-15-24(16-14-23)36-28(35)25-17-18-26(33)32(31-25)19-20-7-5-4-6-8-20/h4-18H,19H2,1-3H3,(H,30,34)