2-methylbutan-2-yl-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium

Systemtic Name: 2-methylbutan-2-yl-[(2S)-2-oxidanyl-2-phenyl-ethyl]azanium Openeye Name: 1,1-dimethylpropyl-[(2S)-2-hydroxy-2-phenyl-ethyl]ammonium CAS Name: [(2S)-2-hydroxy-2-phenylethyl]-(2-methylbutan-2-yl)ammonium IUPAC Name: [(2S)-2-hydroxy-2-phenylethyl]-(2-methylbutan-2-yl)azanium Traditional Name: tert-amyl-[(2S)-2-hydroxy-2-phenyl-ethyl]ammonium Formula: C13H22NO+ MolecularWeight: 208.31988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO/c1-4-13(2,3)14-10-12(15)11-8-6-5-7-9-11/h5-9,12,14-15H,4,10H2,1-3H3/p+1/t12-/m1/s1