diethyl 5-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-(1,3,5-trimethyl-4-pyrazolyl)ethyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CC2=C(N(N=C2C)C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CC2=C(N(N=C2C)C)C)C(=O)OCC

InChI

InChI=1S/C20H25N3O5/c1-6-27-19(25)14-8-15(20(26)28-7-2)10-16(9-14)21-18(24)11-17-12(3)22-23(5)13(17)4/h8-10H,6-7,11H2,1-5H3,(H,21,24)