1-(2-bromanyl-4-fluoranyl-phenyl)-5-(3,4-dimethylphenyl)-2-methyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-(2-bromanyl-4-fluoranyl-phenyl)-5-(3,4-dimethylphenyl)-2-methyl-pyrrole-3-carboxylic acid Openeye Name: 1-(2-bromo-4-fluoro-phenyl)-5-(3,4-dimethylphenyl)-2-methyl-pyrrole-3-carboxylic acid CAS Name: 1-(2-bromo-4-fluorophenyl)-5-(3,4-dimethylphenyl)-2-methyl-3-pyrrolecarboxylic acid IUPAC Name: 1-(2-bromo-4-fluorophenyl)-5-(3,4-dimethylphenyl)-2-methylpyrrole-3-carboxylic acid Traditional Name: 1-(2-bromo-4-fluoro-phenyl)-5-(3,4-dimethylphenyl)-2-methyl-pyrrole-3-carboxylic acid Formula: C20H17BrFNO2 MolecularWeight: 402.256883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=C(N2C3=C(C=C(C=C3)F)Br)C)C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=C(N2C3=C(C=C(C=C3)F)Br)C)C(=O)O)C

InChI

InChI=1S/C20H17BrFNO2/c1-11-4-5-14(8-12(11)2)19-10-16(20(24)25)13(3)23(19)18-7-6-15(22)9-17(18)21/h4-10H,1-3H3,(H,24,25)