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

Systemtic Name: 1-[3-methoxy-4-(3-piperidin-1-ium-1-ylpropoxy)phenyl]ethanone Openeye Name: 1-[3-methoxy-4-(3-piperidin-1-ium-1-ylpropoxy)phenyl]ethanone CAS Name: 1-[3-methoxy-4-[3-(1-piperidin-1-iumyl)propoxy]phenyl]ethanone IUPAC Name: 1-[3-methoxy-4-(3-piperidin-1-ium-1-ylpropoxy)phenyl]ethanone Traditional Name: 1-[3-methoxy-4-(3-piperidin-1-ium-1-ylpropoxy)phenyl]ethanone Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO3/c1-14(19)15-7-8-16(17(13-15)20-2)21-12-6-11-18-9-4-3-5-10-18/h7-8,13H,3-6,9-12H2,1-2H3/p+1