(1S)-2-(1-methylazepan-1-ium-1-yl)-1-phenyl-ethanol

Systemtic Name: (1S)-2-(1-methylazepan-1-ium-1-yl)-1-phenyl-ethanol Openeye Name: (1S)-2-(1-methylazepan-1-ium-1-yl)-1-phenyl-ethanol CAS Name: (1S)-2-(1-methyl-1-azepan-1-iumyl)-1-phenylethanol IUPAC Name: (1S)-2-(1-methylazepan-1-ium-1-yl)-1-phenylethanol Traditional Name: (1S)-2-(1-methylazepan-1-ium-1-yl)-1-phenyl-ethanol Formula: C15H24NO+ MolecularWeight: 234.35716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24NO/c1-16(11-7-2-3-8-12-16)13-15(17)14-9-5-4-6-10-14/h4-6,9-10,15,17H,2-3,7-8,11-13H2,1H3/q+1/t15-/m1/s1