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

Systemtic Name: methyl 4-[[2-(1-phenylpyrazol-4-yl)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(1-phenylpyrazol-4-yl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[1-oxo-2-(1-phenyl-4-pyrazolyl)ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(1-phenylpyrazol-4-yl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(1-phenylpyrazol-4-yl)acetyl]amino]methyl]benzoic acid methyl ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O3/c1-26-20(25)17-9-7-15(8-10-17)12-21-19(24)11-16-13-22-23(14-16)18-5-3-2-4-6-18/h2-10,13-14H,11-12H2,1H3,(H,21,24)