3-[3,4-dimethyl-2,5-bis(oxidanylidene)pyrrol-1-yl]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[3,4-dimethyl-2,5-bis(oxidanylidene)pyrrol-1-yl]-4-fluoranyl-benzoic acid Openeye Name: 3-(3,4-dimethyl-2,5-dioxo-pyrrol-1-yl)-4-fluoro-benzoic acid CAS Name: 3-(3,4-dimethyl-2,5-dioxo-1-pyrrolyl)-4-fluorobenzoic acid IUPAC Name: 3-(3,4-dimethyl-2,5-dioxopyrrol-1-yl)-4-fluorobenzoic acid Traditional Name: 3-(2,5-diketo-3,4-dimethyl-3-pyrrolin-1-yl)-4-fluoro-benzoic acid Formula: C13H10FNO4 MolecularWeight: 263.221203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C1=O)C2=C(C=CC(=C2)C(=O)O)F)C

Isomeric SMILES

CC1=C(C(=O)N(C1=O)C2=C(C=CC(=C2)C(=O)O)F)C

InChI

InChI=1S/C13H10FNO4/c1-6-7(2)12(17)15(11(6)16)10-5-8(13(18)19)3-4-9(10)14/h3-5H,1-2H3,(H,18,19)