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

Systemtic Name: 4-(3-fluoranyl-4-methyl-phenyl)carbonyl-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-(3-fluoro-4-methyl-benzoyl)-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[(3-fluoro-4-methylphenyl)-oxomethyl]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-(3-fluoro-4-methylbenzoyl)-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-(3-fluoro-4-methyl-benzoyl)-1-methyl-pyrrole-2-carboxylic acid Formula: C14H12FNO3 MolecularWeight: 261.248383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12FNO3/c1-8-3-4-9(5-11(8)15)13(17)10-6-12(14(18)19)16(2)7-10/h3-7H,1-2H3,(H,18,19)