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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OCC(=O)NC(C)(C)C)[NH3+]

Isomeric SMILES

C[C@@H](CCC1=CC=C(C=C1)OCC(=O)NC(C)(C)C)[NH3+]

InChI

InChI=1S/C16H26N2O2/c1-12(17)5-6-13-7-9-14(10-8-13)20-11-15(19)18-16(2,3)4/h7-10,12H,5-6,11,17H2,1-4H3,(H,18,19)/p+1/t12-/m0/s1