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

Systemtic Name: 4-[2-[(2S)-butan-2-yl]phenoxy]butyl-(3-methoxypropyl)azanium Openeye Name: 3-methoxypropyl-[4-[2-[(1S)-1-methylpropyl]phenoxy]butyl]ammonium CAS Name: 4-[2-[(2S)-butan-2-yl]phenoxy]butyl-(3-methoxypropyl)ammonium IUPAC Name: 4-[2-[(2S)-butan-2-yl]phenoxy]butyl-(3-methoxypropyl)azanium Traditional Name: 3-methoxypropyl-[4-[2-[(1S)-1-methylpropyl]phenoxy]butyl]ammonium Formula: C18H32NO2+ MolecularWeight: 294.45218

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCCCC[NH2+]CCCOC

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OCCCC[NH2+]CCCOC

InChI

InChI=1S/C18H31NO2/c1-4-16(2)17-10-5-6-11-18(17)21-15-8-7-12-19-13-9-14-20-3/h5-6,10-11,16,19H,4,7-9,12-15H2,1-3H3/p+1/t16-/m0/s1