[(2S)-2-(4-tert-butylphenyl)-2-oxidanyl-butyl]-ethyl-azanium

Systemtic Name: [(2S)-2-(4-tert-butylphenyl)-2-oxidanyl-butyl]-ethyl-azanium Openeye Name: [(2S)-2-(4-tert-butylphenyl)-2-hydroxy-butyl]-ethyl-ammonium CAS Name: [(2S)-2-(4-tert-butylphenyl)-2-hydroxybutyl]-ethylammonium IUPAC Name: [(2S)-2-(4-tert-butylphenyl)-2-hydroxybutyl]-ethylazanium Traditional Name: [(2S)-2-(4-tert-butylphenyl)-2-hydroxy-butyl]-ethyl-ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C[NH2+]CC)(C1=CC=C(C=C1)C(C)(C)C)O

Isomeric SMILES

CC[C@@](C[NH2+]CC)(C1=CC=C(C=C1)C(C)(C)C)O

InChI

InChI=1S/C16H27NO/c1-6-16(18,12-17-7-2)14-10-8-13(9-11-14)15(3,4)5/h8-11,17-18H,6-7,12H2,1-5H3/p+1/t16-/m1/s1