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

Systemtic Name: methyl 4-[[[1-(2,5-dimethylphenyl)-6-oxidanylidene-4,5-dihydropyridazin-3-yl]carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[1-(2,5-dimethylphenyl)-6-oxo-4,5-dihydropyridazine-3-carbonyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[[1-(2,5-dimethylphenyl)-6-oxo-4,5-dihydropyridazin-3-yl]-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-(2,5-dimethylphenyl)-6-oxo-4,5-dihydropyridazine-3-carbonyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[1-(2,5-dimethylphenyl)-6-keto-4,5-dihydropyridazine-3-carbonyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)N(C)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)N(C)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H25N3O4/c1-15-5-6-16(2)20(13-15)26-21(27)12-11-19(24-26)22(28)25(3)14-17-7-9-18(10-8-17)23(29)30-4/h5-10,13H,11-12,14H2,1-4H3