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

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

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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=CN=CC=C6

Isomeric SMILES

CC(=O)OC(C1=CC=CC=C1)C(=O)OC2C(COC3=C2C=C(C=C3)OCC4=NC5=CC=CC=C5C=C4)CC6=CN=CC=C6

InChI

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