8-methoxy-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]quinoline-4-carboxylate

Systemtic Name: 8-methoxy-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]quinoline-4-carboxylate Openeye Name: 8-methoxy-2-[3-methoxy-4-(p-tolylmethoxy)phenyl]quinoline-4-carboxylate CAS Name: 8-methoxy-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]-4-quinolinecarboxylate IUPAC Name: 8-methoxy-2-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]quinoline-4-carboxylate Traditional Name: 8-methoxy-2-[3-methoxy-4-(4-methylbenzyl)oxy-phenyl]cinchoninate Formula: C26H22NO5- MolecularWeight: 428.45658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=NC4=C(C=CC=C4OC)C(=C3)C(=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=NC4=C(C=CC=C4OC)C(=C3)C(=O)[O-])OC

InChI

InChI=1S/C26H23NO5/c1-16-7-9-17(10-8-16)15-32-22-12-11-18(13-24(22)31-3)21-14-20(26(28)29)19-5-4-6-23(30-2)25(19)27-21/h4-14H,15H2,1-3H3,(H,28,29)/p-1