ethyl 3-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetyl]amino]benzoate CAS Name: 3-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetyl]amino]benzoic acid ethyl ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H23N3O3/c1-4-28-22(27)17-9-8-10-18(13-17)23-21(26)14-20-15(2)24-25(16(20)3)19-11-6-5-7-12-19/h5-13H,4,14H2,1-3H3,(H,23,26)