[2-(4-fluorophenyl)-2-oxidanylidene-ethyl] 3-bromanyl-5-ethoxy-4-methoxy-benzoate

Systemtic Name: [2-(4-fluorophenyl)-2-oxidanylidene-ethyl] 3-bromanyl-5-ethoxy-4-methoxy-benzoate Openeye Name: [2-(4-fluorophenyl)-2-oxo-ethyl] 3-bromo-5-ethoxy-4-methoxy-benzoate CAS Name: 3-bromo-5-ethoxy-4-methoxybenzoic acid [2-(4-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-fluorophenyl)-2-oxoethyl] 3-bromo-5-ethoxy-4-methoxybenzoate Traditional Name: 3-bromo-5-ethoxy-4-methoxy-benzoic acid [2-(4-fluorophenyl)-2-keto-ethyl] ester Formula: C18H16BrFO5 MolecularWeight: 411.219043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)F)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)F)Br)OC

InChI

InChI=1S/C18H16BrFO5/c1-3-24-16-9-12(8-14(19)17(16)23-2)18(22)25-10-15(21)11-4-6-13(20)7-5-11/h4-9H,3,10H2,1-2H3