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

Systemtic Name: [2-(3-bromophenyl)-2-oxidanylidene-ethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [2-(3-bromophenyl)-2-oxo-ethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(3-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromophenyl)-2-oxoethyl] (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-(3-bromophenyl)-2-keto-ethyl] ester Formula: C17H13BrO5 MolecularWeight: 377.18612

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)OCC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C(=O)OCC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H13BrO5/c18-12-5-3-4-11(8-12)13(19)9-22-17(20)16-10-21-14-6-1-2-7-15(14)23-16/h1-8,16H,9-10H2/t16-/m0/s1