2-(azepan-1-ium-1-yl)-N-[(1R)-1-(4-bromophenyl)ethyl]ethanamide

Systemtic Name: 2-(azepan-1-ium-1-yl)-N-[(1R)-1-(4-bromophenyl)ethyl]ethanamide Openeye Name: 2-(azepan-1-ium-1-yl)-N-[(1R)-1-(4-bromophenyl)ethyl]acetamide CAS Name: 2-(1-azepan-1-iumyl)-N-[(1R)-1-(4-bromophenyl)ethyl]acetamide IUPAC Name: 2-(azepan-1-ium-1-yl)-N-[(1R)-1-(4-bromophenyl)ethyl]acetamide Traditional Name: 2-(azepan-1-ium-1-yl)-N-[(1R)-1-(4-bromophenyl)ethyl]acetamide Formula: C16H24BrN2O+ MolecularWeight: 340.27856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(=O)C[NH+]2CCCCCC2

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)Br)NC(=O)C[NH+]2CCCCCC2

InChI

InChI=1S/C16H23BrN2O/c1-13(14-6-8-15(17)9-7-14)18-16(20)12-19-10-4-2-3-5-11-19/h6-9,13H,2-5,10-12H2,1H3,(H,18,20)/p+1/t13-/m1/s1