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

Systemtic Name: diethyl 5-[3-(1-phenylpyrazol-4-yl)propanoylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[3-(1-phenylpyrazol-4-yl)propanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-3-(1-phenyl-4-pyrazolyl)propyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[3-(1-phenylpyrazol-4-yl)propanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(1-phenylpyrazol-4-yl)propanoylamino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CCC2=CN(N=C2)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CCC2=CN(N=C2)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C24H25N3O5/c1-3-31-23(29)18-12-19(24(30)32-4-2)14-20(13-18)26-22(28)11-10-17-15-25-27(16-17)21-8-6-5-7-9-21/h5-9,12-16H,3-4,10-11H2,1-2H3,(H,26,28)