[5,7-bis(bromanyl)quinolin-8-yl] 4-(3-methyl-5-phenyl-pyrazol-1-yl)benzoate

Systemtic Name: [5,7-bis(bromanyl)quinolin-8-yl] 4-(3-methyl-5-phenyl-pyrazol-1-yl)benzoate Openeye Name: (5,7-dibromo-8-quinolyl) 4-(3-methyl-5-phenyl-pyrazol-1-yl)benzoate CAS Name: 4-(3-methyl-5-phenyl-1-pyrazolyl)benzoic acid (5,7-dibromo-8-quinolinyl) ester IUPAC Name: (5,7-dibromoquinolin-8-yl) 4-(3-methyl-5-phenylpyrazol-1-yl)benzoate Traditional Name: 4-(3-methyl-5-phenyl-pyrazol-1-yl)benzoic acid (5,7-dibromo-8-quinolyl) ester Formula: C26H17Br2N3O2 MolecularWeight: 563.24008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC4=C(C=C(C5=C4N=CC=C5)Br)Br

Isomeric SMILES

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)OC4=C(C=C(C5=C4N=CC=C5)Br)Br

InChI

InChI=1S/C26H17Br2N3O2/c1-16-14-23(17-6-3-2-4-7-17)31(30-16)19-11-9-18(10-12-19)26(32)33-25-22(28)15-21(27)20-8-5-13-29-24(20)25/h2-15H,1H3