diethyl 5-[(1-phenylpyrazol-4-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[(1-phenylpyrazol-4-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[(1-phenylpyrazole-4-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-(1-phenyl-4-pyrazolyl)methyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(1-phenylpyrazole-4-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(1-phenylpyrazole-4-carbonyl)amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=CN(N=C2)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)C2=CN(N=C2)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C22H21N3O5/c1-3-29-21(27)15-10-16(22(28)30-4-2)12-18(11-15)24-20(26)17-13-23-25(14-17)19-8-6-5-7-9-19/h5-14H,3-4H2,1-2H3,(H,24,26)