1-(azepan-1-yl)-2-(4-bromanylphenoxy)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(4-bromanylphenoxy)ethanone Openeye Name: 1-(azepan-1-yl)-2-(4-bromophenoxy)ethanone CAS Name: 1-(1-azepanyl)-2-(4-bromophenoxy)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(4-bromophenoxy)ethanone Traditional Name: 1-(azepan-1-yl)-2-(4-bromophenoxy)ethanone Formula: C14H18BrNO2 MolecularWeight: 312.20222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC2=CC=C(C=C2)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H18BrNO2/c15-12-5-7-13(8-6-12)18-11-14(17)16-9-3-1-2-4-10-16/h5-8H,1-4,9-11H2