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

Systemtic Name: methyl 2-[2-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[3-(4-methoxyphenyl)-6-oxo-pyridazin-1-yl]acetyl]amino]benzoate CAS Name: 2-[[2-[3-(4-methoxyphenyl)-6-oxo-1-pyridazinyl]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]acetyl]amino]benzoate Traditional Name: 2-[[2-[6-keto-3-(4-methoxyphenyl)pyridazin-1-yl]acetyl]amino]benzoic acid methyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H19N3O5/c1-28-15-9-7-14(8-10-15)17-11-12-20(26)24(23-17)13-19(25)22-18-6-4-3-5-16(18)21(27)29-2/h3-12H,13H2,1-2H3,(H,22,25)