3-(3-chloranyl-4,5-dimethoxy-phenyl)propanoate

Systemtic Name: 3-(3-chloranyl-4,5-dimethoxy-phenyl)propanoate Openeye Name: 3-(3-chloro-4,5-dimethoxy-phenyl)propanoate CAS Name: 3-(3-chloro-4,5-dimethoxyphenyl)propanoate IUPAC Name: 3-(3-chloro-4,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3-chloro-4,5-dimethoxy-phenyl)propionate Formula: C11H12ClO4- MolecularWeight: 243.66358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CCC(=O)[O-])Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CCC(=O)[O-])Cl)OC

InChI

InChI=1S/C11H13ClO4/c1-15-9-6-7(3-4-10(13)14)5-8(12)11(9)16-2/h5-6H,3-4H2,1-2H3,(H,13,14)/p-1