4-(3-fluoranyl-4-methyl-phenyl)carbonyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-(3-fluoranyl-4-methyl-phenyl)carbonyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-(3-fluoro-4-methyl-benzoyl)-1H-pyrrole-2-carboxylic acid CAS Name: 4-[(3-fluoro-4-methylphenyl)-oxomethyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-(3-fluoro-4-methylbenzoyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 4-(3-fluoro-4-methyl-benzoyl)-1H-pyrrole-2-carboxylic acid Formula: C13H10FNO3 MolecularWeight: 247.221803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C2=CNC(=C2)C(=O)O)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C2=CNC(=C2)C(=O)O)F

InChI

InChI=1S/C13H10FNO3/c1-7-2-3-8(4-10(7)14)12(16)9-5-11(13(17)18)15-6-9/h2-6,15H,1H3,(H,17,18)