3-chloranyl-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]aniline

Systemtic Name: 3-chloranyl-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]aniline Openeye Name: 3-chloro-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]aniline CAS Name: 3-chloro-4-[[(2S)-2-ethyl-1-piperidin-1-iumyl]methyl]aniline IUPAC Name: 3-chloro-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]aniline Traditional Name: [3-chloro-4-[[(2S)-2-ethylpiperidin-1-ium-1-yl]methyl]phenyl]amine Formula: C14H22ClN2+ MolecularWeight: 253.79088

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=C(C=C(C=C2)N)Cl

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC2=C(C=C(C=C2)N)Cl

InChI

InChI=1S/C14H21ClN2/c1-2-13-5-3-4-8-17(13)10-11-6-7-12(16)9-14(11)15/h6-7,9,13H,2-5,8,10,16H2,1H3/p+1/t13-/m0/s1