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

Systemtic Name: methyl 4-[2-[3-(2,5-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]butanoylamino]benzoate Openeye Name: methyl 4-[2-[3-(2,5-dimethylphenyl)-6-oxo-pyridazin-1-yl]butanoylamino]benzoate CAS Name: 4-[[2-[3-(2,5-dimethylphenyl)-6-oxo-1-pyridazinyl]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[3-(2,5-dimethylphenyl)-6-oxopyridazin-1-yl]butanoylamino]benzoate Traditional Name: 4-[2-[3-(2,5-dimethylphenyl)-6-keto-pyridazin-1-yl]butanoylamino]benzoic acid methyl ester Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OC)N2C(=O)C=CC(=N2)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OC)N2C(=O)C=CC(=N2)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C24H25N3O4/c1-5-21(23(29)25-18-10-8-17(9-11-18)24(30)31-4)27-22(28)13-12-20(26-27)19-14-15(2)6-7-16(19)3/h6-14,21H,5H2,1-4H3,(H,25,29)