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2-[2-[(2S)-butan-2-yl]phenoxy]ethyl-(3-methoxypropyl)azanium

2-[2-[(2S)-butan-2-yl]phenoxy]ethyl-(3-methoxypropyl)azanium

Systemtic Name:2-[2-[(2S)-butan-2-yl]phenoxy]ethyl-(3-methoxypropyl)azanium
Openeye Name:3-methoxypropyl-[2-[2-[(1S)-1-methylpropyl]phenoxy]ethyl]ammonium
CAS Name:2-[2-[(2S)-butan-2-yl]phenoxy]ethyl-(3-methoxypropyl)ammonium
IUPAC Name:2-[2-[(2S)-butan-2-yl]phenoxy]ethyl-(3-methoxypropyl)azanium
Traditional Name:3-methoxypropyl-[2-[2-[(1S)-1-methylpropyl]phenoxy]ethyl]ammonium
Formula: C16H28NO2+
MolecularWeight: 266.39902
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCC[NH2+]CCCOC


Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OCC[NH2+]CCCOC


InChI

InChI=1S/C16H27NO2/c1-4-14(2)15-8-5-6-9-16(15)19-13-11-17-10-7-12-18-3/h5-6,8-9,14,17H,4,7,10-13H2,1-3H3/p+1/t14-/m0/s1


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