dimethyl 9-(4-fluorophenyl)-6-methyl-benzo[g][1,3]benzodioxole-7,8-dicarboxylate

Systemtic Name: dimethyl 9-(4-fluorophenyl)-6-methyl-benzo[g][1,3]benzodioxole-7,8-dicarboxylate Openeye Name: dimethyl 9-(4-fluorophenyl)-6-methyl-benzo[g][1,3]benzodioxole-7,8-dicarboxylate CAS Name: 9-(4-fluorophenyl)-6-methylbenzo[g][1,3]benzodioxole-7,8-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 9-(4-fluorophenyl)-6-methylbenzo[g][1,3]benzodioxole-7,8-dicarboxylate Traditional Name: 9-(4-fluorophenyl)-6-methyl-benzo[g][1,3]benzodioxole-7,8-dicarboxylic acid dimethyl ester Formula: C22H17FO6 MolecularWeight: 396.365183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1C=CC3=C2OCO3)C4=CC=C(C=C4)F)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1C=CC3=C2OCO3)C4=CC=C(C=C4)F)C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H17FO6/c1-11-14-8-9-15-20(29-10-28-15)18(14)17(12-4-6-13(23)7-5-12)19(22(25)27-3)16(11)21(24)26-2/h4-9H,10H2,1-3H3