1-[(3-fluorophenyl)methyl]-2,5-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-[(3-fluorophenyl)methyl]-2,5-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 1-[(3-fluorophenyl)methyl]-2,5-dimethyl-pyrrole-3-carboxylic acid CAS Name: 1-[(3-fluorophenyl)methyl]-2,5-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 1-[(3-fluorophenyl)methyl]-2,5-dimethylpyrrole-3-carboxylic acid Traditional Name: 1-(3-fluorobenzyl)-2,5-dimethyl-pyrrole-3-carboxylic acid Formula: C14H14FNO2 MolecularWeight: 247.264863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC(=CC=C2)F)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1CC2=CC(=CC=C2)F)C)C(=O)O

InChI

InChI=1S/C14H14FNO2/c1-9-6-13(14(17)18)10(2)16(9)8-11-4-3-5-12(15)7-11/h3-7H,8H2,1-2H3,(H,17,18)