1-[2-[3-(4-methylpiperidin-1-ium-1-yl)propoxy]phenyl]propan-1-one

Systemtic Name: 1-[2-[3-(4-methylpiperidin-1-ium-1-yl)propoxy]phenyl]propan-1-one Openeye Name: 1-[2-[3-(4-methylpiperidin-1-ium-1-yl)propoxy]phenyl]propan-1-one CAS Name: 1-[2-[3-(4-methyl-1-piperidin-1-iumyl)propoxy]phenyl]-1-propanone IUPAC Name: 1-[2-[3-(4-methylpiperidin-1-ium-1-yl)propoxy]phenyl]propan-1-one Traditional Name: 1-[2-[3-(4-methylpiperidin-1-ium-1-yl)propoxy]phenyl]propan-1-one Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=CC=C1OCCC[NH+]2CCC(CC2)C

Isomeric SMILES

CCC(=O)C1=CC=CC=C1OCCC[NH+]2CCC(CC2)C

InChI

InChI=1S/C18H27NO2/c1-3-17(20)16-7-4-5-8-18(16)21-14-6-11-19-12-9-15(2)10-13-19/h4-5,7-8,15H,3,6,9-14H2,1-2H3/p+1