N-(5-azanyl-2-methyl-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-azanyl-2-methyl-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]ethanamide Openeye Name: N-(5-amino-2-methyl-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]acetamide CAS Name: N-(5-amino-2-methylphenyl)-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(5-amino-2-methylphenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]acetamide Traditional Name: N-(5-amino-2-methyl-phenyl)-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]acetamide Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O/c1-3-14-6-4-5-9-19(14)11-16(20)18-15-10-13(17)8-7-12(15)2/h7-8,10,14H,3-6,9,11,17H2,1-2H3,(H,18,20)/p+1/t14-/m0/s1