1,3-benzodioxol-5-ylmethyl 2-(4-fluorophenyl)quinoline-4-carboxylate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl 2-(4-fluorophenyl)quinoline-4-carboxylate Openeye Name: 1,3-benzodioxol-5-ylmethyl 2-(4-fluorophenyl)quinoline-4-carboxylate CAS Name: 2-(4-fluorophenyl)-4-quinolinecarboxylic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl 2-(4-fluorophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-fluorophenyl)cinchoninic acid piperonyl ester Formula: C24H16FNO4 MolecularWeight: 401.386543

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F

InChI

InChI=1S/C24H16FNO4/c25-17-8-6-16(7-9-17)21-12-19(18-3-1-2-4-20(18)26-21)24(27)28-13-15-5-10-22-23(11-15)30-14-29-22/h1-12H,13-14H2