(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(6,7-dimethyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(6,7-dimethyl-1-benzofuran-3-yl)ethanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-(6,7-dimethylbenzofuran-3-yl)acetate CAS Name: 2-(6,7-dimethyl-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-(6,7-dimethyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(6,7-dimethylbenzofuran-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:

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)OCC3=C4C(=CC(=C3)Cl)COCO4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CO2)CC(=O)OCC3=C4C(=CC(=C3)Cl)COCO4)C

InChI

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