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

Systemtic Name: methyl 2-[4-[3-(furan-2-yl)-6-oxidanylidene-pyridazin-1-yl]butanoylamino]benzoate Openeye Name: methyl 2-[4-[3-(2-furyl)-6-oxo-pyridazin-1-yl]butanoylamino]benzoate CAS Name: 2-[[4-[3-(2-furanyl)-6-oxo-1-pyridazinyl]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[3-(furan-2-yl)-6-oxopyridazin-1-yl]butanoylamino]benzoate Traditional Name: 2-[4-[3-(2-furyl)-6-keto-pyridazin-1-yl]butanoylamino]benzoic acid methyl ester Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CO3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CO3

InChI

InChI=1S/C20H19N3O5/c1-27-20(26)14-6-2-3-7-15(14)21-18(24)9-4-12-23-19(25)11-10-16(22-23)17-8-5-13-28-17/h2-3,5-8,10-11,13H,4,9,12H2,1H3,(H,21,24)