2-methoxy-5-[(4-oxidanyl-6-quinolin-2-yloxy-3,4-dihydro-2H-chromen-3-yl)methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[(4-oxidanyl-6-quinolin-2-yloxy-3,4-dihydro-2H-chromen-3-yl)methyl]benzoic acid Openeye Name: 5-[[4-hydroxy-6-(2-quinolyloxy)chroman-3-yl]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[4-hydroxy-6-(2-quinolinyloxy)-3,4-dihydro-2H-1-benzopyran-3-yl]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[(4-hydroxy-6-quinolin-2-yloxy-3,4-dihydro-2H-chromen-3-yl)methyl]-2-methoxybenzoic acid Traditional Name: 5-[[4-hydroxy-6-(2-quinolyloxy)chroman-3-yl]methyl]-2-methoxy-benzoic acid Formula: C27H23NO6 MolecularWeight: 457.47462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2COC3=C(C2O)C=C(C=C3)OC4=NC5=CC=CC=C5C=C4)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CC2COC3=C(C2O)C=C(C=C3)OC4=NC5=CC=CC=C5C=C4)C(=O)O

InChI

InChI=1S/C27H23NO6/c1-32-23-9-6-16(13-21(23)27(30)31)12-18-15-33-24-10-8-19(14-20(24)26(18)29)34-25-11-7-17-4-2-3-5-22(17)28-25/h2-11,13-14,18,26,29H,12,15H2,1H3,(H,30,31)