phenacyl 3-bromanyl-4,5-dimethoxy-benzoate

Systemtic Name: phenacyl 3-bromanyl-4,5-dimethoxy-benzoate Openeye Name: phenacyl 3-bromo-4,5-dimethoxy-benzoate CAS Name: 3-bromo-4,5-dimethoxybenzoic acid phenacyl ester IUPAC Name: phenacyl 3-bromo-4,5-dimethoxybenzoate Traditional Name: 3-bromo-4,5-dimethoxy-benzoic acid phenacyl ester Formula: C17H15BrO5 MolecularWeight: 379.202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)OCC(=O)C2=CC=CC=C2)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)OCC(=O)C2=CC=CC=C2)Br)OC

InChI

InChI=1S/C17H15BrO5/c1-21-15-9-12(8-13(18)16(15)22-2)17(20)23-10-14(19)11-6-4-3-5-7-11/h3-9H,10H2,1-2H3