ethyl 6-bromanyl-6-[4-(phenylmethyl)phenyl]hexanoate

Systemtic Name: ethyl 6-bromanyl-6-[4-(phenylmethyl)phenyl]hexanoate Openeye Name: ethyl 6-(4-benzylphenyl)-6-bromo-hexanoate CAS Name: 6-bromo-6-[4-(phenylmethyl)phenyl]hexanoic acid ethyl ester IUPAC Name: ethyl 6-(4-benzylphenyl)-6-bromohexanoate Traditional Name: 6-(4-benzylphenyl)-6-bromo-hexanoic acid ethyl ester Formula: C21H25BrO2 MolecularWeight: 389.326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC(C1=CC=C(C=C1)CC2=CC=CC=C2)Br

Isomeric SMILES

CCOC(=O)CCCCC(C1=CC=C(C=C1)CC2=CC=CC=C2)Br

InChI

InChI=1S/C21H25BrO2/c1-2-24-21(23)11-7-6-10-20(22)19-14-12-18(13-15-19)16-17-8-4-3-5-9-17/h3-5,8-9,12-15,20H,2,6-7,10-11,16H2,1H3