2-(2,4-diethoxyphenyl)-8-methyl-quinoline-4-carboxylate

Systemtic Name: 2-(2,4-diethoxyphenyl)-8-methyl-quinoline-4-carboxylate Openeye Name: 2-(2,4-diethoxyphenyl)-8-methyl-quinoline-4-carboxylate CAS Name: 2-(2,4-diethoxyphenyl)-8-methyl-4-quinolinecarboxylate IUPAC Name: 2-(2,4-diethoxyphenyl)-8-methylquinoline-4-carboxylate Traditional Name: 2-(2,4-diethoxyphenyl)-8-methyl-cinchoninate Formula: C21H20NO4- MolecularWeight: 350.3878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)[O-])OCC

Isomeric SMILES

CCOC1=CC(=C(C=C1)C2=NC3=C(C=CC=C3C)C(=C2)C(=O)[O-])OCC

InChI

InChI=1S/C21H21NO4/c1-4-25-14-9-10-16(19(11-14)26-5-2)18-12-17(21(23)24)15-8-6-7-13(3)20(15)22-18/h6-12H,4-5H2,1-3H3,(H,23,24)/p-1