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

Systemtic Name: 2-[2-[2-[(2S)-butan-2-yl]phenoxy]ethoxy]ethyl-(3-methoxypropyl)azanium Openeye Name: 3-methoxypropyl-[2-[2-[2-[(1S)-1-methylpropyl]phenoxy]ethoxy]ethyl]ammonium CAS Name: 2-[2-[2-[(2S)-butan-2-yl]phenoxy]ethoxy]ethyl-(3-methoxypropyl)ammonium IUPAC Name: 2-[2-[2-[(2S)-butan-2-yl]phenoxy]ethoxy]ethyl-(3-methoxypropyl)azanium Traditional Name: 3-methoxypropyl-[2-[2-[2-[(1S)-1-methylpropyl]phenoxy]ethoxy]ethyl]ammonium Formula: C18H32NO3+ MolecularWeight: 310.45158

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCCOCC[NH2+]CCCOC

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OCCOCC[NH2+]CCCOC

InChI

InChI=1S/C18H31NO3/c1-4-16(2)17-8-5-6-9-18(17)22-15-14-21-13-11-19-10-7-12-20-3/h5-6,8-9,16,19H,4,7,10-15H2,1-3H3/p+1/t16-/m0/s1