1-(azepan-1-yl)-2-(4-bromanyl-2,5-dimethyl-phenoxy)ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(4-bromanyl-2,5-dimethyl-phenoxy)ethanone Openeye Name: 1-(azepan-1-yl)-2-(4-bromo-2,5-dimethyl-phenoxy)ethanone CAS Name: 1-(1-azepanyl)-2-(4-bromo-2,5-dimethylphenoxy)ethanone IUPAC Name: 1-(azepan-1-yl)-2-(4-bromo-2,5-dimethylphenoxy)ethanone Traditional Name: 1-(azepan-1-yl)-2-(4-bromo-2,5-dimethyl-phenoxy)ethanone Formula: C16H22BrNO2 MolecularWeight: 340.25538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)OCC(=O)N2CCCCCC2

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)OCC(=O)N2CCCCCC2

InChI

InChI=1S/C16H22BrNO2/c1-12-10-15(13(2)9-14(12)17)20-11-16(19)18-7-5-3-4-6-8-18/h9-10H,3-8,11H2,1-2H3