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

Systemtic Name: ethyl 2-[(4-bromophenyl)-(2-methoxy-2-oxidanylidene-ethanoyl)carbamoyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylate Openeye Name: ethyl 2-[(4-bromophenyl)-(2-methoxy-2-oxo-acetyl)carbamoyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylate CAS Name: 2-[(4-bromo-N-(2-methoxy-1,2-dioxoethyl)anilino)-oxomethyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-bromophenyl)-(2-methoxy-2-oxoacetyl)carbamoyl]-5-(4-chlorophenyl)-4-methyl-3H-pyrazole-4-carboxylate Traditional Name: 1-[(4-bromophenyl)-methoxalyl-carbamoyl]-3-(4-chlorophenyl)-4-methyl-2-pyrazoline-4-carboxylic acid ethyl ester Formula: C23H21BrClN3O6 MolecularWeight: 550.78634

Click to see the large picture

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)C(=O)OC)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)C(=O)OC)C

InChI

InChI=1S/C23H21BrClN3O6/c1-4-34-21(31)23(2)13-27(26-18(23)14-5-9-16(25)10-6-14)22(32)28(19(29)20(30)33-3)17-11-7-15(24)8-12-17/h5-12H,4,13H2,1-3H3