1,3-benzodioxol-5-yl 3-chloranyl-4,5-dimethoxy-benzoate

Systemtic Name: 1,3-benzodioxol-5-yl 3-chloranyl-4,5-dimethoxy-benzoate Openeye Name: 1,3-benzodioxol-5-yl 3-chloro-4,5-dimethoxy-benzoate CAS Name: 3-chloro-4,5-dimethoxybenzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-chloro-4,5-dimethoxybenzoate Traditional Name: 3-chloro-4,5-dimethoxy-benzoic acid 1,3-benzodioxol-5-yl ester Formula: C16H13ClO6 MolecularWeight: 336.72382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)OC2=CC3=C(C=C2)OCO3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)OC2=CC3=C(C=C2)OCO3)Cl)OC

InChI

InChI=1S/C16H13ClO6/c1-19-14-6-9(5-11(17)15(14)20-2)16(18)23-10-3-4-12-13(7-10)22-8-21-12/h3-7H,8H2,1-2H3