1-[2-[4-[(3S)-3-methylpiperidin-1-ium-1-yl]butoxy]phenyl]ethanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCCOC2=CC=CC=C2C(=O)C

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCCCOC2=CC=CC=C2C(=O)C

InChI

InChI=1S/C18H27NO2/c1-15-8-7-12-19(14-15)11-5-6-13-21-18-10-4-3-9-17(18)16(2)20/h3-4,9-10,15H,5-8,11-14H2,1-2H3/p+1/t15-/m0/s1