[2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 2-bromanyl-3,4,5-trimethoxy-benzoate

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] 2-bromanyl-3,4,5-trimethoxy-benzoate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] 2-bromo-3,4,5-trimethoxy-benzoate CAS Name: 2-bromo-3,4,5-trimethoxybenzoic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] 2-bromo-3,4,5-trimethoxybenzoate Traditional Name: 2-bromo-3,4,5-trimethoxy-benzoic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C18H16BrClO6 MolecularWeight: 443.67304

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)Cl)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)Cl)Br)OC)OC

InChI

InChI=1S/C18H16BrClO6/c1-23-14-8-12(15(19)17(25-3)16(14)24-2)18(22)26-9-13(21)10-4-6-11(20)7-5-10/h4-8H,9H2,1-3H3