2-(5-methoxy-1-benzofuran-2-yl)-5,7-dimethyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(5-methoxy-1-benzofuran-2-yl)-5,7-dimethyl-quinoline-4-carboxylic acid Openeye Name: 2-(5-methoxybenzofuran-2-yl)-5,7-dimethyl-quinoline-4-carboxylic acid CAS Name: 2-(5-methoxy-2-benzofuranyl)-5,7-dimethyl-4-quinolinecarboxylic acid IUPAC Name: 2-(5-methoxy-1-benzofuran-2-yl)-5,7-dimethylquinoline-4-carboxylic acid Traditional Name: 2-(5-methoxybenzofuran-2-yl)-5,7-dimethyl-cinchoninic acid Formula: C21H17NO4 MolecularWeight: 347.36398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=CC(=NC2=C1)C3=CC4=C(O3)C=CC(=C4)OC)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=CC(=NC2=C1)C3=CC4=C(O3)C=CC(=C4)OC)C(=O)O)C

InChI

InChI=1S/C21H17NO4/c1-11-6-12(2)20-15(21(23)24)10-16(22-17(20)7-11)19-9-13-8-14(25-3)4-5-18(13)26-19/h4-10H,1-3H3,(H,23,24)