N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]pentanamide

Systemtic Name: N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-yl-ethyl]pentanamide Openeye Name: N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]pentanamide CAS Name: N-[(2R)-2-(4-methylphenyl)-2-(1-piperidin-1-iumyl)ethyl]pentanamide IUPAC Name: N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ium-1-ylethyl]pentanamide Traditional Name: N-[(2R)-2-piperidin-1-ium-1-yl-2-(p-tolyl)ethyl]valeramide Formula: C19H31N2O+ MolecularWeight: 303.46224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O/c1-3-4-8-19(22)20-15-18(21-13-6-5-7-14-21)17-11-9-16(2)10-12-17/h9-12,18H,3-8,13-15H2,1-2H3,(H,20,22)/p+1/t18-/m0/s1