N-[1-(2-oxidanyl-2-phenyl-ethyl)azepan-1-ium-1-yl]ethanamide

Systemtic Name: N-[1-(2-oxidanyl-2-phenyl-ethyl)azepan-1-ium-1-yl]ethanamide Openeye Name: N-[1-(2-hydroxy-2-phenyl-ethyl)azepan-1-ium-1-yl]acetamide CAS Name: N-[1-(2-hydroxy-2-phenylethyl)-1-azepan-1-iumyl]acetamide IUPAC Name: N-[1-(2-hydroxy-2-phenylethyl)azepan-1-ium-1-yl]acetamide Traditional Name: N-[1-(2-hydroxy-2-phenyl-ethyl)azepan-1-ium-1-yl]acetamide Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N[N+]1(CCCCCC1)CC(C2=CC=CC=C2)O

Isomeric SMILES

CC(=O)N[N+]1(CCCCCC1)CC(C2=CC=CC=C2)O

InChI

InChI=1S/C16H24N2O2/c1-14(19)17-18(11-7-2-3-8-12-18)13-16(20)15-9-5-4-6-10-15/h4-6,9-10,16,20H,2-3,7-8,11-13H2,1H3/p+1