3-chloranyl-4-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxy-aniline

Systemtic Name: 3-chloranyl-4-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxy-aniline Openeye Name: 3-chloro-4-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxy-aniline CAS Name: 3-chloro-4-[[(3S)-1-ethyl-3-piperidin-1-iumyl]oxy]aniline IUPAC Name: 3-chloro-4-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxyaniline Traditional Name: [3-chloro-4-[(3S)-1-ethylpiperidin-1-ium-3-yl]oxy-phenyl]amine Formula: C13H20ClN2O+ MolecularWeight: 255.7637

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC(C1)OC2=C(C=C(C=C2)N)Cl

Isomeric SMILES

CC[NH+]1CCC[C@@H](C1)OC2=C(C=C(C=C2)N)Cl

InChI

InChI=1S/C13H19ClN2O/c1-2-16-7-3-4-11(9-16)17-13-6-5-10(15)8-12(13)14/h5-6,8,11H,2-4,7,9,15H2,1H3/p+1/t11-/m0/s1