N-(3-azanyl-4-chloranyl-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-azanyl-4-chloranyl-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-amino-4-chloro-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(3-amino-4-chlorophenyl)-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(3-amino-4-chlorophenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(3-amino-4-chloro-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]acetamide Formula: C15H23ClN3O+ MolecularWeight: 296.81562

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC(=O)NC2=CC(=C(C=C2)Cl)N

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC(=O)NC2=CC(=C(C=C2)Cl)N

InChI

InChI=1S/C15H22ClN3O/c1-2-12-5-3-4-8-19(12)10-15(20)18-11-6-7-13(16)14(17)9-11/h6-7,9,12H,2-5,8,10,17H2,1H3,(H,18,20)/p+1/t12-/m0/s1