(2-oxidanylidene-1,2-diphenyl-ethyl) 8-bromanyloctanoate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 8-bromanyloctanoate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 8-bromooctanoate CAS Name: 8-bromooctanoic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 8-bromooctanoate Traditional Name: 8-bromocaprylic acid desyl ester Formula: C22H25BrO3 MolecularWeight: 417.3361

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)CCCCCCCBr

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)CCCCCCCBr

InChI

InChI=1S/C22H25BrO3/c23-17-11-3-1-2-10-16-20(24)26-22(19-14-8-5-9-15-19)21(25)18-12-6-4-7-13-18/h4-9,12-15,22H,1-3,10-11,16-17H2