2-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxyaniline

Systemtic Name: 2-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxyaniline Openeye Name: 2-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxyaniline CAS Name: 2-[[(3S)-1-ethyl-3-piperidin-1-iumyl]oxy]aniline IUPAC Name: 2-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxyaniline Traditional Name: [2-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxyphenyl]amine Formula: C13H21N2O+ MolecularWeight: 221.31864

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC(C1)OC2=CC=CC=C2N

Isomeric SMILES

CC[NH+]1CCC[C@@H](C1)OC2=CC=CC=C2N

InChI

InChI=1S/C13H20N2O/c1-2-15-9-5-6-11(10-15)16-13-8-4-3-7-12(13)14/h3-4,7-8,11H,2,5-6,9-10,14H2,1H3/p+1/t11-/m0/s1