(3S)-3-[4-[(2S)-butan-2-yl]phenoxy]piperidin-1-ium

Systemtic Name: (3S)-3-[4-[(2S)-butan-2-yl]phenoxy]piperidin-1-ium Openeye Name: (3S)-3-[4-[(1S)-1-methylpropyl]phenoxy]piperidin-1-ium CAS Name: (3S)-3-[4-[(2S)-butan-2-yl]phenoxy]piperidin-1-ium IUPAC Name: (3S)-3-[4-[(2S)-butan-2-yl]phenoxy]piperidin-1-ium Traditional Name: (3S)-3-[4-[(1S)-1-methylpropyl]phenoxy]piperidin-1-ium Formula: C15H24NO+ MolecularWeight: 234.35716

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OC2CCC[NH2+]C2

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)O[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C15H23NO/c1-3-12(2)13-6-8-14(9-7-13)17-15-5-4-10-16-11-15/h6-9,12,15-16H,3-5,10-11H2,1-2H3/p+1/t12-,15-/m0/s1