2-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-8-methoxy-quinoline-4-carboxylic acid

Systemtic Name: 2-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-8-methoxy-quinoline-4-carboxylic acid Openeye Name: 2-[3-ethoxy-4-(p-tolylmethoxy)phenyl]-8-methoxy-quinoline-4-carboxylic acid CAS Name: 2-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-8-methoxy-4-quinolinecarboxylic acid IUPAC Name: 2-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-8-methoxyquinoline-4-carboxylic acid Traditional Name: 2-[3-ethoxy-4-(4-methylbenzyl)oxy-phenyl]-8-methoxy-cinchoninic acid Formula: C27H25NO5 MolecularWeight: 443.4911

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=NC3=C(C=CC=C3OC)C(=C2)C(=O)O)OCC4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=NC3=C(C=CC=C3OC)C(=C2)C(=O)O)OCC4=CC=C(C=C4)C

InChI

InChI=1S/C27H25NO5/c1-4-32-25-14-19(12-13-23(25)33-16-18-10-8-17(2)9-11-18)22-15-21(27(29)30)20-6-5-7-24(31-3)26(20)28-22/h5-15H,4,16H2,1-3H3,(H,29,30)