2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-phenyl-ethanamide

Systemtic Name: 2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-phenyl-ethanamide Openeye Name: 2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-phenyl-acetamide CAS Name: 2-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propylamino]-N-phenylacetamide IUPAC Name: 2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-phenylacetamide Traditional Name: 2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-N-phenyl-acetamide Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNCC(=O)NC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O/c1-15-8-5-6-12-20(15)13-7-11-18-14-17(21)19-16-9-3-2-4-10-16/h2-4,9-10,15,18H,5-8,11-14H2,1H3,(H,19,21)/p+1/t15-/m0/s1