[(2S)-3,3-dimethyl-2-oxidanyl-butyl]-(phenylmethyl)azanium

Systemtic Name: [(2S)-3,3-dimethyl-2-oxidanyl-butyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(2S)-2-hydroxy-3,3-dimethyl-butyl]ammonium CAS Name: [(2S)-2-hydroxy-3,3-dimethylbutyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2S)-2-hydroxy-3,3-dimethylbutyl]azanium Traditional Name: benzyl-[(2S)-2-hydroxy-3,3-dimethyl-butyl]ammonium Formula: C13H22NO+ MolecularWeight: 208.31988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C[NH2+]CC1=CC=CC=C1)O

Isomeric SMILES

CC(C)(C)[C@@H](C[NH2+]CC1=CC=CC=C1)O

InChI

InChI=1S/C13H21NO/c1-13(2,3)12(15)10-14-9-11-7-5-4-6-8-11/h4-8,12,14-15H,9-10H2,1-3H3/p+1/t12-/m1/s1