2-[4-[(2S)-butan-2-yl]phenoxy]ethyl-(3-methoxypropyl)azanium

Systemtic Name: 2-[4-[(2S)-butan-2-yl]phenoxy]ethyl-(3-methoxypropyl)azanium Openeye Name: 3-methoxypropyl-[2-[4-[(1S)-1-methylpropyl]phenoxy]ethyl]ammonium CAS Name: 2-[4-[(2S)-butan-2-yl]phenoxy]ethyl-(3-methoxypropyl)ammonium IUPAC Name: 2-[4-[(2S)-butan-2-yl]phenoxy]ethyl-(3-methoxypropyl)azanium Traditional Name: 3-methoxypropyl-[2-[4-[(1S)-1-methylpropyl]phenoxy]ethyl]ammonium Formula: C16H28NO2+ MolecularWeight: 266.39902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO2/c1-4-14(2)15-6-8-16(9-7-15)19-13-11-17-10-5-12-18-3/h6-9,14,17H,4-5,10-13H2,1-3H3/p+1/t14-/m0/s1