[(2S)-butan-2-yl]-[(2R)-2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(2R)-2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]azanium Openeye Name: [(2R)-2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(2R)-2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(2R)-2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]azanium Traditional Name: [(2R)-2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]-[(1S)-1-methylpropyl]ammonium Formula: C14H24NO3+ MolecularWeight: 254.34526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23NO3/c1-5-10(2)15-9-12(16)11-6-7-13(17-3)14(8-11)18-4/h6-8,10,12,15-16H,5,9H2,1-4H3/p+1/t10-,12-/m0/s1