1-[2-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propoxy]phenyl]ethanone

Systemtic Name: 1-[2-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propoxy]phenyl]ethanone Openeye Name: 1-[2-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propoxy]phenyl]ethanone CAS Name: 1-[2-[3-[(3S)-3-methyl-1-piperidin-1-iumyl]propoxy]phenyl]ethanone IUPAC Name: 1-[2-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propoxy]phenyl]ethanone Traditional Name: 1-[2-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propoxy]phenyl]ethanone Formula: C17H26NO2+ MolecularWeight: 276.39384

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCOC2=CC=CC=C2C(=O)C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCCOC2=CC=CC=C2C(=O)C

InChI

InChI=1S/C17H25NO2/c1-14-7-5-10-18(13-14)11-6-12-20-17-9-4-3-8-16(17)15(2)19/h3-4,8-9,14H,5-7,10-13H2,1-2H3/p+1/t14-/m0/s1