[2-(3-bromophenyl)-2-oxidanylidene-ethyl] 3,4,5-triethoxybenzoate

Systemtic Name: [2-(3-bromophenyl)-2-oxidanylidene-ethyl] 3,4,5-triethoxybenzoate Openeye Name: [2-(3-bromophenyl)-2-oxo-ethyl] 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid [2-(3-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-bromophenyl)-2-oxoethyl] 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid [2-(3-bromophenyl)-2-keto-ethyl] ester Formula: C21H23BrO6 MolecularWeight: 451.30772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C21H23BrO6/c1-4-25-18-11-15(12-19(26-5-2)20(18)27-6-3)21(24)28-13-17(23)14-8-7-9-16(22)10-14/h7-12H,4-6,13H2,1-3H3