(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(6-ethyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(6-ethyl-1-benzofuran-3-yl)ethanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-(6-ethylbenzofuran-3-yl)acetate CAS Name: 2-(6-ethyl-3-benzofuranyl)acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-(6-ethyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-ethylbenzofuran-3-yl)acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C21H19ClO5 MolecularWeight: 386.82556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CO2)CC(=O)OCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C21H19ClO5/c1-2-13-3-4-18-14(10-25-19(18)5-13)8-20(23)26-11-16-7-17(22)6-15-9-24-12-27-21(15)16/h3-7,10H,2,8-9,11-12H2,1H3