2-phenoxyethyl 4-bromanyl-3,5-dimethoxy-benzoate

Systemtic Name: 2-phenoxyethyl 4-bromanyl-3,5-dimethoxy-benzoate Openeye Name: 2-phenoxyethyl 4-bromo-3,5-dimethoxy-benzoate CAS Name: 4-bromo-3,5-dimethoxybenzoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 4-bromo-3,5-dimethoxybenzoate Traditional Name: 4-bromo-3,5-dimethoxy-benzoic acid 2-phenoxyethyl ester Formula: C17H17BrO5 MolecularWeight: 381.21788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)OCCOC2=CC=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)OCCOC2=CC=CC=C2

InChI

InChI=1S/C17H17BrO5/c1-20-14-10-12(11-15(21-2)16(14)18)17(19)23-9-8-22-13-6-4-3-5-7-13/h3-7,10-11H,8-9H2,1-2H3