methyl 4-[[1-(2,5-dimethylphenyl)-6-oxidanylidene-4,5-dihydropyridazin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-(2,5-dimethylphenyl)-6-oxidanylidene-4,5-dihydropyridazin-3-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-(2,5-dimethylphenyl)-6-oxo-4,5-dihydropyridazine-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-(2,5-dimethylphenyl)-6-oxo-4,5-dihydropyridazin-3-yl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(2,5-dimethylphenyl)-6-oxo-4,5-dihydropyridazine-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-(2,5-dimethylphenyl)-6-keto-4,5-dihydropyridazine-3-carbonyl]amino]benzoic acid methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H21N3O4/c1-13-4-5-14(2)18(12-13)24-19(25)11-10-17(23-24)20(26)22-16-8-6-15(7-9-16)21(27)28-3/h4-9,12H,10-11H2,1-3H3,(H,22,26)