[4-[(2R,3R)-2-[[2-(2,6-dimethoxyphenoxy)ethylamino]methyl]-2,3-dihydro-1,4-benzodioxin-3-yl]phenyl] ethanoate

Systemtic Name: [4-[(2R,3R)-2-[[2-(2,6-dimethoxyphenoxy)ethylamino]methyl]-2,3-dihydro-1,4-benzodioxin-3-yl]phenyl] ethanoate Openeye Name: [4-[(2R,3R)-2-[[2-(2,6-dimethoxyphenoxy)ethylamino]methyl]-2,3-dihydro-1,4-benzodioxin-3-yl]phenyl] acetate CAS Name: acetic acid [4-[(2R,3R)-2-[[2-(2,6-dimethoxyphenoxy)ethylamino]methyl]-2,3-dihydro-1,4-benzodioxin-3-yl]phenyl] ester IUPAC Name: [4-[(2R,3R)-2-[[2-(2,6-dimethoxyphenoxy)ethylamino]methyl]-2,3-dihydro-1,4-benzodioxin-3-yl]phenyl] acetate Traditional Name: acetic acid [4-[(2R,3R)-2-[[2-(2,6-dimethoxyphenoxy)ethylamino]methyl]-2,3-dihydro-1,4-benzodioxin-3-yl]phenyl] ester Formula: C27H29NO7 MolecularWeight: 479.52166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2C(OC3=CC=CC=C3O2)CNCCOC4=C(C=CC=C4OC)OC

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)[C@@H]2[C@H](OC3=CC=CC=C3O2)CNCCOC4=C(C=CC=C4OC)OC

InChI

InChI=1S/C27H29NO7/c1-18(29)33-20-13-11-19(12-14-20)26-25(34-21-7-4-5-8-22(21)35-26)17-28-15-16-32-27-23(30-2)9-6-10-24(27)31-3/h4-14,25-26,28H,15-17H2,1-3H3/t25-,26-/m1/s1