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

Systemtic Name: methyl 2-[4-[3-(3-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]butanoylamino]benzoate Openeye Name: methyl 2-[4-[3-(3-methoxyphenyl)-6-oxo-pyridazin-1-yl]butanoylamino]benzoate CAS Name: 2-[[4-[3-(3-methoxyphenyl)-6-oxo-1-pyridazinyl]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[3-(3-methoxyphenyl)-6-oxopyridazin-1-yl]butanoylamino]benzoate Traditional Name: 2-[4-[6-keto-3-(3-methoxyphenyl)pyridazin-1-yl]butanoylamino]benzoic acid methyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O5/c1-30-17-8-5-7-16(15-17)19-12-13-22(28)26(25-19)14-6-11-21(27)24-20-10-4-3-9-18(20)23(29)31-2/h3-5,7-10,12-13,15H,6,11,14H2,1-2H3,(H,24,27)