[1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] 6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-[(4-phenylmethoxyphenyl)amino]propan-2-yl] 6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxylate Openeye Name: [2-(4-benzyloxyanilino)-1-methyl-2-oxo-ethyl] 1-benzyl-6-oxo-pyridazine-3-carboxylate CAS Name: 6-oxo-1-(phenylmethyl)-3-pyridazinecarboxylic acid [1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylmethoxyanilino)propan-2-yl] 1-benzyl-6-oxopyridazine-3-carboxylate Traditional Name: 1-benzyl-6-keto-pyridazine-3-carboxylic acid [2-(4-benzoxyanilino)-2-keto-1-methyl-ethyl] ester Formula: C28H25N3O5 MolecularWeight: 483.5152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)OC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C28H25N3O5/c1-20(27(33)29-23-12-14-24(15-13-23)35-19-22-10-6-3-7-11-22)36-28(34)25-16-17-26(32)31(30-25)18-21-8-4-2-5-9-21/h2-17,20H,18-19H2,1H3,(H,29,33)