[(2S)-butan-2-yl]-[(2R)-2-(3-chlorophenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(2R)-2-(3-chlorophenyl)-2-oxidanyl-ethyl]azanium Openeye Name: [(2R)-2-(3-chlorophenyl)-2-hydroxy-ethyl]-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]azanium Traditional Name: [(2R)-2-(3-chlorophenyl)-2-hydroxy-ethyl]-[(1S)-1-methylpropyl]ammonium Formula: C12H19ClNO+ MolecularWeight: 228.73836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18ClNO/c1-3-9(2)14-8-12(15)10-5-4-6-11(13)7-10/h4-7,9,12,14-15H,3,8H2,1-2H3/p+1/t9-,12-/m0/s1