1-[3-methoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethanone

Systemtic Name: 1-[3-methoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethanone Openeye Name: 1-[3-methoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethanone CAS Name: 1-[3-methoxy-4-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]ethanone IUPAC Name: 1-[3-methoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethanone Traditional Name: 1-[3-methoxy-4-(2-piperidin-1-ium-1-ylethoxy)phenyl]ethanone Formula: C16H24NO3+ MolecularWeight: 278.36666

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC[NH+]2CCCCC2)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCC[NH+]2CCCCC2)OC

InChI

InChI=1S/C16H23NO3/c1-13(18)14-6-7-15(16(12-14)19-2)20-11-10-17-8-4-3-5-9-17/h6-7,12H,3-5,8-11H2,1-2H3/p+1