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

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 5-chloranyl-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 5-chloro-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 5-chloro-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 5-chloro-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 5-chloro-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C17H12BrClO5 MolecularWeight: 411.63118

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)C(=O)OCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)C(=O)OCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H12BrClO5/c18-12-3-1-10(2-4-12)14(20)9-24-17(21)11-7-13(19)16-15(8-11)22-5-6-23-16/h1-4,7-8H,5-6,9H2