(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(5-ethanoyl-2-methoxy-phenyl)ethanoate

Systemtic Name: (6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl 2-(5-ethanoyl-2-methoxy-phenyl)ethanoate Openeye Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-(5-acetyl-2-methoxy-phenyl)acetate CAS Name: 2-(5-acetyl-2-methoxyphenyl)acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-chloro-4H-1,3-benzodioxin-8-yl)methyl 2-(5-acetyl-2-methoxyphenyl)acetate Traditional Name: 2-(5-acetyl-2-methoxy-phenyl)acetic acid (6-chloro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C20H19ClO6 MolecularWeight: 390.81426

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)OCC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C20H19ClO6/c1-12(22)13-3-4-18(24-2)14(5-13)8-19(23)26-10-16-7-17(21)6-15-9-25-11-27-20(15)16/h3-7H,8-11H2,1-2H3