1-(azepan-1-yl)-2-(2-bromanyl-4-ethyl-phenoxy)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(2-bromanyl-4-ethyl-phenoxy)ethanone Openeye Name: 1-(azepan-1-yl)-2-(2-bromo-4-ethyl-phenoxy)ethanone CAS Name: 1-(1-azepanyl)-2-(2-bromo-4-ethylphenoxy)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(2-bromo-4-ethylphenoxy)ethanone Traditional Name: 1-(azepan-1-yl)-2-(2-bromo-4-ethyl-phenoxy)ethanone Formula: C16H22BrNO2 MolecularWeight: 340.25538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)N2CCCCCC2)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)N2CCCCCC2)Br

InChI

InChI=1S/C16H22BrNO2/c1-2-13-7-8-15(14(17)11-13)20-12-16(19)18-9-5-3-4-6-10-18/h7-8,11H,2-6,9-10,12H2,1H3