2-[5,7-bis(chloranyl)-1-benzofuran-2-yl]-6-ethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-[5,7-bis(chloranyl)-1-benzofuran-2-yl]-6-ethyl-quinoline-4-carboxylic acid Openeye Name: 2-(5,7-dichlorobenzofuran-2-yl)-6-ethyl-quinoline-4-carboxylic acid CAS Name: 2-(5,7-dichloro-2-benzofuranyl)-6-ethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(5,7-dichloro-1-benzofuran-2-yl)-6-ethylquinoline-4-carboxylic acid Traditional Name: 2-(5,7-dichlorobenzofuran-2-yl)-6-ethyl-cinchoninic acid Formula: C20H13Cl2NO3 MolecularWeight: 386.22812

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC4=CC(=CC(=C4O3)Cl)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC4=CC(=CC(=C4O3)Cl)Cl

InChI

InChI=1S/C20H13Cl2NO3/c1-2-10-3-4-16-13(5-10)14(20(24)25)9-17(23-16)18-7-11-6-12(21)8-15(22)19(11)26-18/h3-9H,2H2,1H3,(H,24,25)