(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 5-methoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-methoxy-3-methyl-2-benzofurancarboxylic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 5-methoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-methoxy-3-methyl-coumarilic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C20H17ClO6 MolecularWeight: 388.79838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C20H17ClO6/c1-11-16-7-15(23-2)3-4-17(16)27-18(11)20(22)25-9-13-6-14(21)5-12-8-24-10-26-19(12)13/h3-7H,8-10H2,1-2H3