[4-[(3-methylphenyl)carbonylamino]phenyl] 1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: [4-[(3-methylphenyl)carbonylamino]phenyl] 1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: [4-[(3-methylbenzoyl)amino]phenyl] 1-benzylpyrazole-4-carboxylate CAS Name: 1-(phenylmethyl)-4-pyrazolecarboxylic acid [4-[[(3-methylphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(3-methylbenzoyl)amino]phenyl] 1-benzylpyrazole-4-carboxylate Traditional Name: 1-benzylpyrazole-4-carboxylic acid [4-(m-toluoylamino)phenyl] ester Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)OC(=O)C3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)OC(=O)C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O3/c1-18-6-5-9-20(14-18)24(29)27-22-10-12-23(13-11-22)31-25(30)21-15-26-28(17-21)16-19-7-3-2-4-8-19/h2-15,17H,16H2,1H3,(H,27,29)