methyl 4-methyl-3-[2-[2-(1-phenylpyrazol-4-yl)ethanoyloxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[2-(1-phenylpyrazol-4-yl)ethanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[2-(1-phenylpyrazol-4-yl)acetyl]oxyacetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[1-oxo-2-(1-phenyl-4-pyrazolyl)ethoxy]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[2-(1-phenylpyrazol-4-yl)acetyl]oxyacetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[2-(1-phenylpyrazol-4-yl)acetyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3O5/c1-15-8-9-17(22(28)29-2)11-19(15)24-20(26)14-30-21(27)10-16-12-23-25(13-16)18-6-4-3-5-7-18/h3-9,11-13H,10,14H2,1-2H3,(H,24,26)