(2R,3R)-2-(4-methoxy-3-propoxy-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid

Systemtic Name: (2R,3R)-2-(4-methoxy-3-propoxy-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid Openeye Name: (2R,3R)-2-(4-methoxy-3-propoxy-phenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid CAS Name: (2R,3R)-2-(4-methoxy-3-propoxyphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid IUPAC Name: (2R,3R)-2-(4-methoxy-3-propoxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxylic acid Traditional Name: (2R,3R)-2-(4-methoxy-3-propoxy-phenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid Formula: C19H20O6 MolecularWeight: 344.3585

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1)C2C(OC3=CC=CC=C3O2)C(=O)O)OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)[C@@H]2[C@@H](OC3=CC=CC=C3O2)C(=O)O)OC

InChI

InChI=1S/C19H20O6/c1-3-10-23-16-11-12(8-9-13(16)22-2)17-18(19(20)21)25-15-7-5-4-6-14(15)24-17/h4-9,11,17-18H,3,10H2,1-2H3,(H,20,21)/t17-,18-/m1/s1