(4-methanoyl-2-methoxy-phenyl) 5-bromanyl-2-phenethyloxy-benzoate

Systemtic Name: (4-methanoyl-2-methoxy-phenyl) 5-bromanyl-2-phenethyloxy-benzoate Openeye Name: (4-formyl-2-methoxy-phenyl) 5-bromo-2-phenethyloxy-benzoate CAS Name: 5-bromo-2-phenethyloxybenzoic acid (4-formyl-2-methoxyphenyl) ester IUPAC Name: (4-formyl-2-methoxyphenyl) 5-bromo-2-phenethyloxybenzoate Traditional Name: 5-bromo-2-phenethyloxy-benzoic acid (4-formyl-2-methoxy-phenyl) ester Formula: C23H19BrO5 MolecularWeight: 455.29796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=O)OC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C=O)OC(=O)C2=C(C=CC(=C2)Br)OCCC3=CC=CC=C3

InChI

InChI=1S/C23H19BrO5/c1-27-22-13-17(15-25)7-9-21(22)29-23(26)19-14-18(24)8-10-20(19)28-12-11-16-5-3-2-4-6-16/h2-10,13-15H,11-12H2,1H3