dimethyl 5-[[3-(4-chlorophenyl)-1H-pyrazol-5-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[3-(4-chlorophenyl)-1H-pyrazol-5-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H16ClN3O5 MolecularWeight: 413.81114

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C20H16ClN3O5/c1-28-19(26)12-7-13(20(27)29-2)9-15(8-12)22-18(25)17-10-16(23-24-17)11-3-5-14(21)6-4-11/h3-10H,1-2H3,(H,22,25)(H,23,24)