1-[4-[2-(2-piperidin-1-ium-1-ylethoxy)ethoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[2-(2-piperidin-1-ium-1-ylethoxy)ethoxy]phenyl]propan-1-one Openeye Name: 1-[4-[2-(2-piperidin-1-ium-1-ylethoxy)ethoxy]phenyl]propan-1-one CAS Name: 1-[4-[2-[2-(1-piperidin-1-iumyl)ethoxy]ethoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[2-(2-piperidin-1-ium-1-ylethoxy)ethoxy]phenyl]propan-1-one Traditional Name: 1-[4-[2-(2-piperidin-1-ium-1-ylethoxy)ethoxy]phenyl]propan-1-one Formula: C18H28NO3+ MolecularWeight: 306.41982

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCCOCC[NH+]2CCCCC2

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCCOCC[NH+]2CCCCC2

InChI

InChI=1S/C18H27NO3/c1-2-18(20)16-6-8-17(9-7-16)22-15-14-21-13-12-19-10-4-3-5-11-19/h6-9H,2-5,10-15H2,1H3/p+1