ethyl 2-[(4-bromophenyl)-ethoxycarbonyl-carbamoyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylate

Systemtic Name: ethyl 2-[(4-bromophenyl)-ethoxycarbonyl-carbamoyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylate Openeye Name: ethyl 2-[(4-bromophenyl)-ethoxycarbonyl-carbamoyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylate CAS Name: 2-[(4-bromo-N-ethoxycarbonylanilino)-oxomethyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-bromophenyl)-ethoxycarbonylcarbamoyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylate Traditional Name: 1-[(4-bromophenyl)-carbethoxy-carbamoyl]-3-(4-chlorophenyl)-4-methyl-2-pyrazoline-4-carboxylic acid ethyl ester Formula: C23H23BrClN3O5 MolecularWeight: 536.80282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)N(C3=CC=C(C=C3)Br)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1(CN(N=C1C2=CC=C(C=C2)Cl)C(=O)N(C3=CC=C(C=C3)Br)C(=O)OCC)C

InChI

InChI=1S/C23H23BrClN3O5/c1-4-32-20(29)23(3)14-27(26-19(23)15-6-10-17(25)11-7-15)21(30)28(22(31)33-5-2)18-12-8-16(24)9-13-18/h6-13H,4-5,14H2,1-3H3