(2R,3R)-2-(4-methoxy-3-pentoxy-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (2R,3R)-2-(4-methoxy-3-pentoxy-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (2R,3R)-2-(4-methoxy-3-pentoxy-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (2R,3R)-2-(4-methoxy-3-pentoxyphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxylate IUPAC Name: (2R,3R)-2-(4-methoxy-3-pentoxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (2R,3R)-2-(3-amoxy-4-methoxy-phenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxylate Formula: C21H23O6- MolecularWeight: 371.40372

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1)C2C(OC3=CC=CC=C3O2)C(=O)[O-])OC

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1)[C@@H]2[C@@H](OC3=CC=CC=C3O2)C(=O)[O-])OC

InChI

InChI=1S/C21H24O6/c1-3-4-7-12-25-18-13-14(10-11-15(18)24-2)19-20(21(22)23)27-17-9-6-5-8-16(17)26-19/h5-6,8-11,13,19-20H,3-4,7,12H2,1-2H3,(H,22,23)/p-1/t19-,20-/m1/s1