ethyl 4-[[5-(4-chlorophenyl)-4-methyl-4-phenyl-3H-pyrazol-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[5-(4-chlorophenyl)-4-methyl-4-phenyl-3H-pyrazol-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[5-(4-chlorophenyl)-4-methyl-4-phenyl-3H-pyrazole-2-carbonyl]amino]benzoate CAS Name: 4-[[[5-(4-chlorophenyl)-4-methyl-4-phenyl-3H-pyrazol-2-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-(4-chlorophenyl)-4-methyl-4-phenyl-3H-pyrazole-2-carbonyl]amino]benzoate Traditional Name: 4-[[3-(4-chlorophenyl)-4-methyl-4-phenyl-2-pyrazoline-1-carbonyl]amino]benzoic acid ethyl ester Formula: C26H24ClN3O3 MolecularWeight: 461.94006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CC(C(=N2)C3=CC=C(C=C3)Cl)(C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CC(C(=N2)C3=CC=C(C=C3)Cl)(C)C4=CC=CC=C4

InChI

InChI=1S/C26H24ClN3O3/c1-3-33-24(31)19-11-15-22(16-12-19)28-25(32)30-17-26(2,20-7-5-4-6-8-20)23(29-30)18-9-13-21(27)14-10-18/h4-16H,3,17H2,1-2H3,(H,28,32)