[3-(pyridin-3-ylmethyl)-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-yl] ethanoate

Systemtic Name: [3-(pyridin-3-ylmethyl)-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-yl] ethanoate Openeye Name: [3-(3-pyridylmethyl)-6-(2-quinolylmethoxy)chroman-4-yl] acetate CAS Name: acetic acid [3-(3-pyridinylmethyl)-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-4-yl] ester IUPAC Name: [3-(pyridin-3-ylmethyl)-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-yl] acetate Traditional Name: acetic acid [3-(3-pyridylmethyl)-6-(2-quinolylmethoxy)chroman-4-yl] ester Formula: C27H24N2O4 MolecularWeight: 440.49046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(COC2=C1C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CC5=CN=CC=C5

Isomeric SMILES

CC(=O)OC1C(COC2=C1C=C(C=C2)OCC3=NC4=CC=CC=C4C=C3)CC5=CN=CC=C5

InChI

InChI=1S/C27H24N2O4/c1-18(30)33-27-21(13-19-5-4-12-28-15-19)16-32-26-11-10-23(14-24(26)27)31-17-22-9-8-20-6-2-3-7-25(20)29-22/h2-12,14-15,21,27H,13,16-17H2,1H3