2-(4-hexoxy-3-methoxy-phenyl)-6-methyl-quinoline-4-carboxylate

Systemtic Name: 2-(4-hexoxy-3-methoxy-phenyl)-6-methyl-quinoline-4-carboxylate Openeye Name: 2-(4-hexoxy-3-methoxy-phenyl)-6-methyl-quinoline-4-carboxylate CAS Name: 2-(4-hexoxy-3-methoxyphenyl)-6-methyl-4-quinolinecarboxylate IUPAC Name: 2-(4-hexoxy-3-methoxyphenyl)-6-methylquinoline-4-carboxylate Traditional Name: 2-(4-hexoxy-3-methoxy-phenyl)-6-methyl-cinchoninate Formula: C24H26NO4- MolecularWeight: 392.46754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)[O-])OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)[O-])OC

InChI

InChI=1S/C24H27NO4/c1-4-5-6-7-12-29-22-11-9-17(14-23(22)28-3)21-15-19(24(26)27)18-13-16(2)8-10-20(18)25-21/h8-11,13-15H,4-7,12H2,1-3H3,(H,26,27)/p-1