dimethyl 5-[[5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[5-[(4-chloropyrazol-1-yl)methyl]furan-2-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[5-[(4-chloro-1-pyrazolyl)methyl]-2-furanyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[5-[(4-chloropyrazol-1-yl)methyl]furan-2-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[5-[(4-chloropyrazol-1-yl)methyl]-2-furoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C19H16ClN3O6 MolecularWeight: 417.79984

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl)C(=O)OC

InChI

InChI=1S/C19H16ClN3O6/c1-27-18(25)11-5-12(19(26)28-2)7-14(6-11)22-17(24)16-4-3-15(29-16)10-23-9-13(20)8-21-23/h3-9H,10H2,1-2H3,(H,22,24)