methyl 3-bromanyl-4-methanoyl-2-methoxy-5-phenylmethoxy-benzoate

Systemtic Name: methyl 3-bromanyl-4-methanoyl-2-methoxy-5-phenylmethoxy-benzoate Openeye Name: methyl 5-benzyloxy-3-bromo-4-formyl-2-methoxy-benzoate CAS Name: 3-bromo-4-formyl-2-methoxy-5-phenylmethoxybenzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-formyl-2-methoxy-5-phenylmethoxybenzoate Traditional Name: 5-benzoxy-3-bromo-4-formyl-2-methoxy-benzoic acid methyl ester Formula: C17H15BrO5 MolecularWeight: 379.202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1C(=O)OC)OCC2=CC=CC=C2)C=O)Br

Isomeric SMILES

COC1=C(C(=C(C=C1C(=O)OC)OCC2=CC=CC=C2)C=O)Br

InChI

InChI=1S/C17H15BrO5/c1-21-16-12(17(20)22-2)8-14(13(9-19)15(16)18)23-10-11-6-4-3-5-7-11/h3-9H,10H2,1-2H3