ethyl 3-[3-(1-phenylpyrazol-4-yl)propanoylamino]benzoate

Systemtic Name: ethyl 3-[3-(1-phenylpyrazol-4-yl)propanoylamino]benzoate Openeye Name: ethyl 3-[3-(1-phenylpyrazol-4-yl)propanoylamino]benzoate CAS Name: 3-[[1-oxo-3-(1-phenyl-4-pyrazolyl)propyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-(1-phenylpyrazol-4-yl)propanoylamino]benzoate Traditional Name: 3-[3-(1-phenylpyrazol-4-yl)propanoylamino]benzoic acid ethyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O3/c1-2-27-21(26)17-7-6-8-18(13-17)23-20(25)12-11-16-14-22-24(15-16)19-9-4-3-5-10-19/h3-10,13-15H,2,11-12H2,1H3,(H,23,25)