2-(4-butoxy-3-ethoxy-phenyl)-8-methoxy-quinoline-4-carboxylate

Systemtic Name: 2-(4-butoxy-3-ethoxy-phenyl)-8-methoxy-quinoline-4-carboxylate Openeye Name: 2-(4-butoxy-3-ethoxy-phenyl)-8-methoxy-quinoline-4-carboxylate CAS Name: 2-(4-butoxy-3-ethoxyphenyl)-8-methoxy-4-quinolinecarboxylate IUPAC Name: 2-(4-butoxy-3-ethoxyphenyl)-8-methoxyquinoline-4-carboxylate Traditional Name: 2-(4-butoxy-3-ethoxy-phenyl)-8-methoxy-cinchoninate Formula: C23H24NO5- MolecularWeight: 394.44036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2=NC3=C(C=CC=C3OC)C(=C2)C(=O)[O-])OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2=NC3=C(C=CC=C3OC)C(=C2)C(=O)[O-])OCC

InChI

InChI=1S/C23H25NO5/c1-4-6-12-29-19-11-10-15(13-21(19)28-5-2)18-14-17(23(25)26)16-8-7-9-20(27-3)22(16)24-18/h7-11,13-14H,4-6,12H2,1-3H3,(H,25,26)/p-1