1-(1,3-benzodioxol-5-ylmethyl)-5-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-fluoro-4-keto-1-piperonyl-quinoline-3-carboxylic acid Formula: C18H12FNO5 MolecularWeight: 341.289983

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C=C(C(=O)C4=C3C=CC=C4F)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C=C(C(=O)C4=C3C=CC=C4F)C(=O)O

InChI

InChI=1S/C18H12FNO5/c19-12-2-1-3-13-16(12)17(21)11(18(22)23)8-20(13)7-10-4-5-14-15(6-10)25-9-24-14/h1-6,8H,7,9H2,(H,22,23)