ethyl 5-(4-bromophenyl)-1-[4-(2-methylpyrrolidin-1-yl)carbonylphenyl]pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(4-bromophenyl)-1-[4-(2-methylpyrrolidin-1-yl)carbonylphenyl]pyrazole-3-carboxylate Openeye Name: ethyl 5-(4-bromophenyl)-1-[4-(2-methylpyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxylate CAS Name: 5-(4-bromophenyl)-1-[4-[(2-methyl-1-pyrrolidinyl)-oxomethyl]phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-bromophenyl)-1-[4-(2-methylpyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxylate Traditional Name: 5-(4-bromophenyl)-1-[4-(2-methylpyrrolidine-1-carbonyl)phenyl]pyrazole-3-carboxylic acid ethyl ester Formula: C24H24BrN3O3 MolecularWeight: 482.36966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)C(=O)N4CCCC4C

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=CC=C(C=C2)Br)C3=CC=C(C=C3)C(=O)N4CCCC4C

InChI

InChI=1S/C24H24BrN3O3/c1-3-31-24(30)21-15-22(17-6-10-19(25)11-7-17)28(26-21)20-12-8-18(9-13-20)23(29)27-14-4-5-16(27)2/h6-13,15-16H,3-5,14H2,1-2H3