[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-1-phenyl-pyridazine-3-carboxylate

Systemtic Name: [2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl] 6-methyl-4-oxidanylidene-1-phenyl-pyridazine-3-carboxylate Openeye Name: [2-(3-ethylanilino)-2-oxo-ethyl] 6-methyl-4-oxo-1-phenyl-pyridazine-3-carboxylate CAS Name: 6-methyl-4-oxo-1-phenyl-3-pyridazinecarboxylic acid [2-(3-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylanilino)-2-oxoethyl] 6-methyl-4-oxo-1-phenylpyridazine-3-carboxylate Traditional Name: 4-keto-6-methyl-1-phenyl-pyridazine-3-carboxylic acid [2-(3-ethylanilino)-2-keto-ethyl] ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)COC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)COC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3O4/c1-3-16-8-7-9-17(13-16)23-20(27)14-29-22(28)21-19(26)12-15(2)25(24-21)18-10-5-4-6-11-18/h4-13H,3,14H2,1-2H3,(H,23,27)