N-[(2S)-1-methoxypropan-2-yl]-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-[(2S)-1-methoxypropan-2-yl]-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-[(1S)-2-methoxy-1-methyl-ethyl]-1-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-[(2S)-1-methoxypropan-2-yl]-1-(3-pyridinylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-[(2S)-1-methoxypropan-2-yl]-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-[(1S)-2-methoxy-1-methyl-ethyl]-1-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=O)C1CC[NH+](CC1)CC2=CN=CC=C2

Isomeric SMILES

C[C@@H](COC)NC(=O)C1CC[NH+](CC1)CC2=CN=CC=C2

InChI

InChI=1S/C16H25N3O2/c1-13(12-21-2)18-16(20)15-5-8-19(9-6-15)11-14-4-3-7-17-10-14/h3-4,7,10,13,15H,5-6,8-9,11-12H2,1-2H3,(H,18,20)/p+1/t13-/m0/s1