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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

InChI

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