1-[4-[2-(4-methylpiperidin-1-ium-1-yl)ethoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[2-(4-methylpiperidin-1-ium-1-yl)ethoxy]phenyl]propan-1-one Openeye Name: 1-[4-[2-(4-methylpiperidin-1-ium-1-yl)ethoxy]phenyl]propan-1-one CAS Name: 1-[4-[2-(4-methyl-1-piperidin-1-iumyl)ethoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[2-(4-methylpiperidin-1-ium-1-yl)ethoxy]phenyl]propan-1-one Traditional Name: 1-[4-[2-(4-methylpiperidin-1-ium-1-yl)ethoxy]phenyl]propan-1-one Formula: C17H26NO2+ MolecularWeight: 276.39384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC[NH+]2CCC(CC2)C

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC[NH+]2CCC(CC2)C

InChI

InChI=1S/C17H25NO2/c1-3-17(19)15-4-6-16(7-5-15)20-13-12-18-10-8-14(2)9-11-18/h4-7,14H,3,8-13H2,1-2H3/p+1