[(2S)-1-(2,4-ditert-butylphenoxy)propan-2-yl]azanium

Systemtic Name: [(2S)-1-(2,4-ditert-butylphenoxy)propan-2-yl]azanium Openeye Name: [(1S)-2-(2,4-ditert-butylphenoxy)-1-methyl-ethyl]ammonium CAS Name: [(2S)-1-(2,4-ditert-butylphenoxy)propan-2-yl]ammonium IUPAC Name: [(2S)-1-(2,4-ditert-butylphenoxy)propan-2-yl]azanium Traditional Name: [(1S)-2-(2,4-ditert-butylphenoxy)-1-methyl-ethyl]ammonium Formula: C17H30NO+ MolecularWeight: 264.4262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(C=C(C=C1)C(C)(C)C)C(C)(C)C)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C17H29NO/c1-12(18)11-19-15-9-8-13(16(2,3)4)10-14(15)17(5,6)7/h8-10,12H,11,18H2,1-7H3/p+1/t12-/m0/s1