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

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2,3,4-trimethoxybenzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C18H17BrO6 MolecularWeight: 409.22798

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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)Br)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrO6/c1-22-15-9-8-13(16(23-2)17(15)24-3)18(21)25-10-14(20)11-4-6-12(19)7-5-11/h4-9H,10H2,1-3H3