N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]pentanamide

Systemtic Name: N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]pentanamide Openeye Name: N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]pentanamide CAS Name: N-[(2R)-2-phenyl-2-(1-piperidin-1-iumyl)ethyl]pentanamide IUPAC Name: N-[(2R)-2-phenyl-2-piperidin-1-ium-1-ylethyl]pentanamide Traditional Name: N-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]valeramide Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NCC(C1=CC=CC=C1)[NH+]2CCCCC2

Isomeric SMILES

CCCCC(=O)NC[C@@H](C1=CC=CC=C1)[NH+]2CCCCC2

InChI

InChI=1S/C18H28N2O/c1-2-3-12-18(21)19-15-17(16-10-6-4-7-11-16)20-13-8-5-9-14-20/h4,6-7,10-11,17H,2-3,5,8-9,12-15H2,1H3,(H,19,21)/p+1/t17-/m0/s1