1-(2-fluoranyl-5-nitro-phenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-(2-fluoranyl-5-nitro-phenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 1-(2-fluoro-5-nitro-phenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid CAS Name: 1-(2-fluoro-5-nitrophenyl)-2,5-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 1-(2-fluoro-5-nitrophenyl)-2,5-dimethylpyrrole-3-carboxylic acid Traditional Name: 1-(2-fluoro-5-nitro-phenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid Formula: C13H11FN2O4 MolecularWeight: 278.235843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C=CC(=C2)[N+](=O)[O-])F)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=CC(=C2)[N+](=O)[O-])F)C)C(=O)O

InChI

InChI=1S/C13H11FN2O4/c1-7-5-10(13(17)18)8(2)15(7)12-6-9(16(19)20)3-4-11(12)14/h3-6H,1-2H3,(H,17,18)