[(2S)-butan-2-yl]-[(2R)-2-(4-tert-butylphenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(2R)-2-(4-tert-butylphenyl)-2-oxidanyl-ethyl]azanium Openeye Name: [(2R)-2-(4-tert-butylphenyl)-2-hydroxy-ethyl]-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(2R)-2-(4-tert-butylphenyl)-2-hydroxyethyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(2R)-2-(4-tert-butylphenyl)-2-hydroxyethyl]azanium Traditional Name: [(2R)-2-(4-tert-butylphenyl)-2-hydroxy-ethyl]-[(1S)-1-methylpropyl]ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO/c1-6-12(2)17-11-15(18)13-7-9-14(10-8-13)16(3,4)5/h7-10,12,15,17-18H,6,11H2,1-5H3/p+1/t12-,15-/m0/s1