1-[2-[2-[(2S)-butan-2-yl]phenoxy]ethyl]-4-methyl-piperidin-1-ium

Systemtic Name: 1-[2-[2-[(2S)-butan-2-yl]phenoxy]ethyl]-4-methyl-piperidin-1-ium Openeye Name: 4-methyl-1-[2-[2-[(1S)-1-methylpropyl]phenoxy]ethyl]piperidin-1-ium CAS Name: 1-[2-[2-[(2S)-butan-2-yl]phenoxy]ethyl]-4-methylpiperidin-1-ium IUPAC Name: 1-[2-[2-[(2S)-butan-2-yl]phenoxy]ethyl]-4-methylpiperidin-1-ium Traditional Name: 4-methyl-1-[2-[2-[(1S)-1-methylpropyl]phenoxy]ethyl]piperidin-1-ium Formula: C18H30NO+ MolecularWeight: 276.4369

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC[NH+]2CCC(CC2)C

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OCC[NH+]2CCC(CC2)C

InChI

InChI=1S/C18H29NO/c1-4-16(3)17-7-5-6-8-18(17)20-14-13-19-11-9-15(2)10-12-19/h5-8,15-16H,4,9-14H2,1-3H3/p+1/t16-/m0/s1