2-[5,7-bis(chloranyl)-1-benzofuran-2-yl]-5,8-dimethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-[5,7-bis(chloranyl)-1-benzofuran-2-yl]-5,8-dimethyl-quinoline-4-carboxylic acid Openeye Name: 2-(5,7-dichlorobenzofuran-2-yl)-5,8-dimethyl-quinoline-4-carboxylic acid CAS Name: 2-(5,7-dichloro-2-benzofuranyl)-5,8-dimethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(5,7-dichloro-1-benzofuran-2-yl)-5,8-dimethylquinoline-4-carboxylic acid Traditional Name: 2-(5,7-dichlorobenzofuran-2-yl)-5,8-dimethyl-cinchoninic acid Formula: C20H13Cl2NO3 MolecularWeight: 386.22812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=NC2=C(C=C1)C)C3=CC4=CC(=CC(=C4O3)Cl)Cl)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=NC2=C(C=C1)C)C3=CC4=CC(=CC(=C4O3)Cl)Cl)C(=O)O

InChI

InChI=1S/C20H13Cl2NO3/c1-9-3-4-10(2)18-17(9)13(20(24)25)8-15(23-18)16-6-11-5-12(21)7-14(22)19(11)26-16/h3-8H,1-2H3,(H,24,25)