[2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3,5-bis(bromanyl)-2-oxidanyl-benzoate

Systemtic Name: [2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 3,5-bis(bromanyl)-2-oxidanyl-benzoate Openeye Name: [2-(3,5-dimethoxyanilino)-2-oxo-ethyl] 3,5-dibromo-2-hydroxy-benzoate CAS Name: 3,5-dibromo-2-hydroxybenzoic acid [2-(3,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethoxyanilino)-2-oxoethyl] 3,5-dibromo-2-hydroxybenzoate Traditional Name: 3,5-dibromo-2-hydroxy-benzoic acid [2-(3,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C17H15Br2NO6 MolecularWeight: 489.1121

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)COC(=O)C2=CC(=CC(=C2O)Br)Br)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)COC(=O)C2=CC(=CC(=C2O)Br)Br)OC

InChI

InChI=1S/C17H15Br2NO6/c1-24-11-5-10(6-12(7-11)25-2)20-15(21)8-26-17(23)13-3-9(18)4-14(19)16(13)22/h3-7,22H,8H2,1-2H3,(H,20,21)