[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 5-methoxy-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 5-methoxy-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C18H15BrO6 MolecularWeight: 407.2121

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCO2)C(=O)OCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC(=CC2=C1OCCO2)C(=O)OCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H15BrO6/c1-22-15-8-12(9-16-17(15)24-7-6-23-16)18(21)25-10-14(20)11-2-4-13(19)5-3-11/h2-5,8-9H,6-7,10H2,1H3