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6-[2-(dimethoxymethyl)phenyl]hex-5-ynyl 4-bromanylbenzoate

6-[2-(dimethoxymethyl)phenyl]hex-5-ynyl 4-bromanylbenzoate

Systemtic Name:6-[2-(dimethoxymethyl)phenyl]hex-5-ynyl 4-bromanylbenzoate
Openeye Name:6-[2-(dimethoxymethyl)phenyl]hex-5-ynyl 4-bromobenzoate
CAS Name:4-bromobenzoic acid 6-[2-(dimethoxymethyl)phenyl]hex-5-ynyl ester
IUPAC Name:6-[2-(dimethoxymethyl)phenyl]hex-5-ynyl 4-bromobenzoate
Traditional Name:4-bromobenzoic acid 6-[2-(dimethoxymethyl)phenyl]hex-5-ynyl ester
Formula: C22H23BrO4
MolecularWeight: 431.31962
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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=CC=C1C#CCCCCOC(=O)C2=CC=C(C=C2)Br)OC


Isomeric SMILES

COC(C1=CC=CC=C1C#CCCCCOC(=O)C2=CC=C(C=C2)Br)OC


InChI

InChI=1S/C22H23BrO4/c1-25-22(26-2)20-11-7-6-10-17(20)9-5-3-4-8-16-27-21(24)18-12-14-19(23)15-13-18/h6-7,10-15,22H,3-4,8,16H2,1-2H3


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