3-(pyridin-3-ylmethyl)-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-ol dihydrochloride

Systemtic Name: 3-(pyridin-3-ylmethyl)-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-ol dihydrochloride Openeye Name: 3-(3-pyridylmethyl)-6-(2-quinolylmethoxy)chroman-4-ol dihydrochloride CAS Name: 3-(3-pyridinylmethyl)-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-4-ol dihydrochloride IUPAC Name: 3-(pyridin-3-ylmethyl)-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-ol dihydrochloride Traditional Name: 3-(3-pyridylmethyl)-6-(2-quinolylmethoxy)chroman-4-ol dihydrochloride Formula: C25H24Cl2N2O3 MolecularWeight: 471.37566

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=C(O1)C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)O)CC5=CN=CC=C5.Cl.Cl

Isomeric SMILES

C1C(C(C2=C(O1)C=CC(=C2)OCC3=NC4=CC=CC=C4C=C3)O)CC5=CN=CC=C5.Cl.Cl

InChI

InChI=1S/C25H22N2O3.2ClH/c28-25-19(12-17-4-3-11-26-14-17)15-30-24-10-9-21(13-22(24)25)29-16-20-8-7-18-5-1-2-6-23(18)27-20;;/h1-11,13-14,19,25,28H,12,15-16H2;2*1H