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

Systemtic Name: [3-(pyridin-2-ylmethyl)-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-yl] 2-acetyloxy-2-phenyl-ethanoate Openeye Name: [3-(2-pyridylmethyl)-6-(2-quinolylmethoxy)chroman-4-yl] 2-acetoxy-2-phenyl-acetate CAS Name: 2-acetyloxy-2-phenylacetic acid [3-(2-pyridinylmethyl)-6-(2-quinolinylmethoxy)-3,4-dihydro-2H-1-benzopyran-4-yl] ester IUPAC Name: [3-(pyridin-2-ylmethyl)-6-(quinolin-2-ylmethoxy)-3,4-dihydro-2H-chromen-4-yl] 2-acetyloxy-2-phenylacetate Traditional Name: 2-acetoxy-2-phenyl-acetic acid [3-(2-pyridylmethyl)-6-(2-quinolylmethoxy)chroman-4-yl] ester Formula: C35H30N2O6 MolecularWeight: 574.6225

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC=CC=C1)C(=O)OC2C(COC3=C2C=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)CC6=CC=CC=N6

Isomeric SMILES

CC(=O)OC(C1=CC=CC=C1)C(=O)OC2C(COC3=C2C=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)CC6=CC=CC=N6

InChI

InChI=1S/C35H30N2O6/c1-23(38)42-34(25-10-3-2-4-11-25)35(39)43-33-26(19-27-12-7-8-18-36-27)21-41-32-17-16-29(20-30(32)33)40-22-28-15-14-24-9-5-6-13-31(24)37-28/h2-18,20,26,33-34H,19,21-22H2,1H3