methyl 4-[2-[3-[(4-methylphenyl)carbamoyl]-6-oxidanylidene-pyridazin-1-yl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[3-[(4-methylphenyl)carbamoyl]-6-oxidanylidene-pyridazin-1-yl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[6-oxo-3-(p-tolylcarbamoyl)pyridazin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[3-[(4-methylanilino)-oxomethyl]-6-oxo-1-pyridazinyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[3-[(4-methylphenyl)carbamoyl]-6-oxopyridazin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[6-keto-3-(p-tolylcarbamoyl)pyridazin-1-yl]acetyl]amino]benzoic acid methyl ester Formula: C22H20N4O5 MolecularWeight: 420.418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H20N4O5/c1-14-3-7-17(8-4-14)24-21(29)18-11-12-20(28)26(25-18)13-19(27)23-16-9-5-15(6-10-16)22(30)31-2/h3-12H,13H2,1-2H3,(H,23,27)(H,24,29)