(2S,3S)-3-methyl-2-phenyl-N-piperidin-1-ium-4-yl-pentanamide

Systemtic Name: (2S,3S)-3-methyl-2-phenyl-N-piperidin-1-ium-4-yl-pentanamide Openeye Name: (2S,3S)-3-methyl-2-phenyl-N-piperidin-1-ium-4-yl-pentanamide CAS Name: (2S,3S)-3-methyl-2-phenyl-N-(4-piperidin-1-iumyl)pentanamide IUPAC Name: (2S,3S)-3-methyl-2-phenyl-N-piperidin-1-ium-4-ylpentanamide Traditional Name: (2S,3S)-3-methyl-2-phenyl-N-piperidin-1-ium-4-yl-valeramide Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)NC2CC[NH2+]CC2

Isomeric SMILES

CC[C@H](C)[C@@H](C1=CC=CC=C1)C(=O)NC2CC[NH2+]CC2

InChI

InChI=1S/C17H26N2O/c1-3-13(2)16(14-7-5-4-6-8-14)17(20)19-15-9-11-18-12-10-15/h4-8,13,15-16,18H,3,9-12H2,1-2H3,(H,19,20)/p+1/t13-,16-/m0/s1