[(2S)-butan-2-yl]-[(2R)-3-(3-methylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(2R)-3-(3-methylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: [(2R)-2-hydroxy-3-(3-methylphenoxy)propyl]-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(2R)-2-hydroxy-3-(3-methylphenoxy)propyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(2R)-2-hydroxy-3-(3-methylphenoxy)propyl]azanium Traditional Name: [(2R)-2-hydroxy-3-(3-methylphenoxy)propyl]-[(1S)-1-methylpropyl]ammonium Formula: C14H24NO2+ MolecularWeight: 238.34586

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC(COC1=CC=CC(=C1)C)O

Isomeric SMILES

CC[C@H](C)[NH2+]C[C@H](COC1=CC=CC(=C1)C)O

InChI

InChI=1S/C14H23NO2/c1-4-12(3)15-9-13(16)10-17-14-7-5-6-11(2)8-14/h5-8,12-13,15-16H,4,9-10H2,1-3H3/p+1/t12-,13+/m0/s1