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(1S)-2-(azepan-1-ium-1-yl)-1-(2-methoxyphenyl)ethanol

(1S)-2-(azepan-1-ium-1-yl)-1-(2-methoxyphenyl)ethanol

Systemtic Name:(1S)-2-(azepan-1-ium-1-yl)-1-(2-methoxyphenyl)ethanol
Openeye Name:(1S)-2-(azepan-1-ium-1-yl)-1-(2-methoxyphenyl)ethanol
CAS Name:(1S)-2-(1-azepan-1-iumyl)-1-(2-methoxyphenyl)ethanol
IUPAC Name:(1S)-2-(azepan-1-ium-1-yl)-1-(2-methoxyphenyl)ethanol
Traditional Name:(1S)-2-(azepan-1-ium-1-yl)-1-(2-methoxyphenyl)ethanol
Formula: C15H24NO2+
MolecularWeight: 250.35656
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(C[NH+]2CCCCCC2)O


Isomeric SMILES

COC1=CC=CC=C1[C@@H](C[NH+]2CCCCCC2)O


InChI

InChI=1S/C15H23NO2/c1-18-15-9-5-4-8-13(15)14(17)12-16-10-6-2-3-7-11-16/h4-5,8-9,14,17H,2-3,6-7,10-12H2,1H3/p+1/t14-/m1/s1


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