[(2S)-4-[4-[2-(diethylamino)-2-oxidanylidene-ethoxy]phenyl]butan-2-yl]azanium

Systemtic Name: [(2S)-4-[4-[2-(diethylamino)-2-oxidanylidene-ethoxy]phenyl]butan-2-yl]azanium Openeye Name: [(1S)-3-[4-[2-(diethylamino)-2-oxo-ethoxy]phenyl]-1-methyl-propyl]ammonium CAS Name: [(2S)-4-[4-[2-(diethylamino)-2-oxoethoxy]phenyl]butan-2-yl]ammonium IUPAC Name: [(2S)-4-[4-[2-(diethylamino)-2-oxoethoxy]phenyl]butan-2-yl]azanium Traditional Name: [(1S)-3-[4-[2-(diethylamino)-2-keto-ethoxy]phenyl]-1-methyl-propyl]ammonium Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC1=CC=C(C=C1)CCC(C)[NH3+]

Isomeric SMILES

CCN(CC)C(=O)COC1=CC=C(C=C1)CC[C@H](C)[NH3+]

InChI

InChI=1S/C16H26N2O2/c1-4-18(5-2)16(19)12-20-15-10-8-14(9-11-15)7-6-13(3)17/h8-11,13H,4-7,12,17H2,1-3H3/p+1/t13-/m0/s1