[2-[(4-bromophenyl)carbamoyl]-5-(4-chlorophenyl)-3,4-dihydropyrazol-4-yl] benzoate

Systemtic Name: [2-[(4-bromophenyl)carbamoyl]-5-(4-chlorophenyl)-3,4-dihydropyrazol-4-yl] benzoate Openeye Name: [2-[(4-bromophenyl)carbamoyl]-5-(4-chlorophenyl)-3,4-dihydropyrazol-4-yl] benzoate CAS Name: benzoic acid [2-[(4-bromoanilino)-oxomethyl]-5-(4-chlorophenyl)-3,4-dihydropyrazol-4-yl] ester IUPAC Name: [2-[(4-bromophenyl)carbamoyl]-5-(4-chlorophenyl)-3,4-dihydropyrazol-4-yl] benzoate Traditional Name: benzoic acid [1-[(4-bromophenyl)carbamoyl]-3-(4-chlorophenyl)-2-pyrazolin-4-yl] ester Formula: C23H17BrClN3O3 MolecularWeight: 498.75638

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=NN1C(=O)NC2=CC=C(C=C2)Br)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1C(C(=NN1C(=O)NC2=CC=C(C=C2)Br)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H17BrClN3O3/c24-17-8-12-19(13-9-17)26-23(30)28-14-20(31-22(29)16-4-2-1-3-5-16)21(27-28)15-6-10-18(25)11-7-15/h1-13,20H,14H2,(H,26,30)