methyl 5-[[4-[(4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-yl)carbonylamino]pyrazol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[(4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-3-yl)carbonylamino]pyrazol-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-[(4-oxo-6,7-dihydro-5H-benzofuran-3-carbonyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[4-[[oxo-(4-oxo-6,7-dihydro-5H-benzofuran-3-yl)methyl]amino]-1-pyrazolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(4-oxo-6,7-dihydro-5H-1-benzofuran-3-carbonyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[(4-keto-6,7-dihydro-5H-benzofuran-3-carbonyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C19H17N3O6 MolecularWeight: 383.35478

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CN2C=C(C=N2)NC(=O)C3=COC4=C3C(=O)CCC4

Isomeric SMILES

COC(=O)C1=CC=C(O1)CN2C=C(C=N2)NC(=O)C3=COC4=C3C(=O)CCC4

InChI

InChI=1S/C19H17N3O6/c1-26-19(25)16-6-5-12(28-16)9-22-8-11(7-20-22)21-18(24)13-10-27-15-4-2-3-14(23)17(13)15/h5-8,10H,2-4,9H2,1H3,(H,21,24)