ethyl 4-aminocarbonyl-1-(2-bromophenyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-1-(2-bromophenyl)-5-(4-methoxyphenyl)pyrazole-3-carboxylate Openeye Name: ethyl 1-(2-bromophenyl)-4-carbamoyl-5-(4-methoxyphenyl)pyrazole-3-carboxylate CAS Name: 1-(2-bromophenyl)-4-carbamoyl-5-(4-methoxyphenyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-bromophenyl)-4-carbamoyl-5-(4-methoxyphenyl)pyrazole-3-carboxylate Traditional Name: 1-(2-bromophenyl)-4-carbamoyl-5-(4-methoxyphenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C20H18BrN3O4 MolecularWeight: 444.27862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1C(=O)N)C2=CC=C(C=C2)OC)C3=CC=CC=C3Br

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1C(=O)N)C2=CC=C(C=C2)OC)C3=CC=CC=C3Br

InChI

InChI=1S/C20H18BrN3O4/c1-3-28-20(26)17-16(19(22)25)18(12-8-10-13(27-2)11-9-12)24(23-17)15-7-5-4-6-14(15)21/h4-11H,3H2,1-2H3,(H2,22,25)