dimethyl 5-[[1-(pyrazol-1-ylmethyl)pyrazol-3-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[1-(pyrazol-1-ylmethyl)pyrazol-3-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[1-(pyrazol-1-ylmethyl)pyrazole-3-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-[1-(1-pyrazolylmethyl)-3-pyrazolyl]methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[1-(pyrazol-1-ylmethyl)pyrazole-3-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[1-(pyrazol-1-ylmethyl)pyrazole-3-carbonyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C18H17N5O5 MolecularWeight: 383.35808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N5O5/c1-27-17(25)12-8-13(18(26)28-2)10-14(9-12)20-16(24)15-4-7-23(21-15)11-22-6-3-5-19-22/h3-10H,11H2,1-2H3,(H,20,24)