2-(1,3-benzodioxol-5-ylmethyl)-6-(quinolin-2-ylmethoxy)-2,3-dihydrochromen-4-one

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-6-(quinolin-2-ylmethoxy)-2,3-dihydrochromen-4-one Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-6-(2-quinolylmethoxy)chroman-4-one CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-6-(quinolin-2-ylmethoxy)-2,3-dihydrochromen-4-one Traditional Name: 2-piperonyl-6-(2-quinolylmethoxy)chroman-4-one Formula: C27H21NO5 MolecularWeight: 439.45934

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(C1=O)C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1C(OC2=C(C1=O)C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C27H21NO5/c29-24-14-21(11-17-5-9-26-27(12-17)32-16-31-26)33-25-10-8-20(13-22(24)25)30-15-19-7-6-18-3-1-2-4-23(18)28-19/h1-10,12-13,21H,11,14-16H2