(2R,3R)-2-(3-chloranyl-4,5-diethoxy-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (2R,3R)-2-(3-chloranyl-4,5-diethoxy-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (2R,3R)-2-(3-chloro-4,5-diethoxy-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (2R,3R)-2-(3-chloro-4,5-diethoxyphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxylate IUPAC Name: (2R,3R)-2-(3-chloro-4,5-diethoxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (2R,3R)-2-(3-chloro-4,5-diethoxy-phenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxylate Formula: C19H18ClO6- MolecularWeight: 377.79562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(OC3=CC=CC=C3O2)C(=O)[O-])Cl)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[C@@H]2[C@@H](OC3=CC=CC=C3O2)C(=O)[O-])Cl)OCC

InChI

InChI=1S/C19H19ClO6/c1-3-23-15-10-11(9-12(20)17(15)24-4-2)16-18(19(21)22)26-14-8-6-5-7-13(14)25-16/h5-10,16,18H,3-4H2,1-2H3,(H,21,22)/p-1/t16-,18-/m1/s1