1-[4-[2-[(2R)-2-pyridin-3-ylpiperidin-1-ium-1-yl]ethoxy]phenyl]ethanone

Systemtic Name: 1-[4-[2-[(2R)-2-pyridin-3-ylpiperidin-1-ium-1-yl]ethoxy]phenyl]ethanone Openeye Name: 1-[4-[2-[(2R)-2-(3-pyridyl)piperidin-1-ium-1-yl]ethoxy]phenyl]ethanone CAS Name: 1-[4-[2-[(2R)-2-(3-pyridinyl)-1-piperidin-1-iumyl]ethoxy]phenyl]ethanone IUPAC Name: 1-[4-[2-[(2R)-2-pyridin-3-ylpiperidin-1-ium-1-yl]ethoxy]phenyl]ethanone Traditional Name: 1-[4-[2-[(2R)-2-(3-pyridyl)piperidin-1-ium-1-yl]ethoxy]phenyl]ethanone Formula: C20H25N2O2+ MolecularWeight: 325.4247

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCC[NH+]2CCCCC2C3=CN=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCC[NH+]2CCCC[C@@H]2C3=CN=CC=C3

InChI

InChI=1S/C20H24N2O2/c1-16(23)17-7-9-19(10-8-17)24-14-13-22-12-3-2-6-20(22)18-5-4-11-21-15-18/h4-5,7-11,15,20H,2-3,6,12-14H2,1H3/p+1/t20-/m1/s1