N-[(2S,5S)-4-acetamido-1,5-dimethyl-2-phenyl-piperidin-1-ium-4-yl]ethanamide

Systemtic Name: N-[(2S,5S)-4-acetamido-1,5-dimethyl-2-phenyl-piperidin-1-ium-4-yl]ethanamide Openeye Name: N-[(2S,5S)-4-acetamido-1,5-dimethyl-2-phenyl-piperidin-1-ium-4-yl]acetamide CAS Name: N-[(2S,5S)-4-acetamido-1,5-dimethyl-2-phenyl-4-piperidin-1-iumyl]acetamide IUPAC Name: N-[(2S,5S)-4-acetamido-1,5-dimethyl-2-phenylpiperidin-1-ium-4-yl]acetamide Traditional Name: N-[(2S,5S)-4-acetamido-1,5-dimethyl-2-phenyl-piperidin-1-ium-4-yl]acetamide Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](C(CC1(NC(=O)C)NC(=O)C)C2=CC=CC=C2)C

Isomeric SMILES

C[C@H]1C[NH+]([C@@H](CC1(NC(=O)C)NC(=O)C)C2=CC=CC=C2)C

InChI

InChI=1S/C17H25N3O2/c1-12-11-20(4)16(15-8-6-5-7-9-15)10-17(12,18-13(2)21)19-14(3)22/h5-9,12,16H,10-11H2,1-4H3,(H,18,21)(H,19,22)/p+1/t12-,16-/m0/s1