2-(3,4-diethoxyphenyl)-8-methoxy-quinoline-4-carboxylic acid

Systemtic Name: 2-(3,4-diethoxyphenyl)-8-methoxy-quinoline-4-carboxylic acid Openeye Name: 2-(3,4-diethoxyphenyl)-8-methoxy-quinoline-4-carboxylic acid CAS Name: 2-(3,4-diethoxyphenyl)-8-methoxy-4-quinolinecarboxylic acid IUPAC Name: 2-(3,4-diethoxyphenyl)-8-methoxyquinoline-4-carboxylic acid Traditional Name: 2-(3,4-diethoxyphenyl)-8-methoxy-cinchoninic acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC3=C(C=CC=C3OC)C(=C2)C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC3=C(C=CC=C3OC)C(=C2)C(=O)O)OCC

InChI

InChI=1S/C21H21NO5/c1-4-26-17-10-9-13(11-19(17)27-5-2)16-12-15(21(23)24)14-7-6-8-18(25-3)20(14)22-16/h6-12H,4-5H2,1-3H3,(H,23,24)