[(1S)-1-(4-methoxy-2-oxidanyl-phenyl)ethyl]-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: [(1S)-1-(4-methoxy-2-oxidanyl-phenyl)ethyl]-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: (2-hydroxy-1,1-dimethyl-ethyl)-[(1S)-1-(2-hydroxy-4-methoxy-phenyl)ethyl]ammonium CAS Name: [(1S)-1-(2-hydroxy-4-methoxyphenyl)ethyl]-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: [(1S)-1-(2-hydroxy-4-methoxyphenyl)ethyl]-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: (2-hydroxy-1,1-dimethyl-ethyl)-[(1S)-1-(2-hydroxy-4-methoxy-phenyl)ethyl]ammonium Formula: C13H22NO3+ MolecularWeight: 240.31868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO3/c1-9(14-13(2,3)8-15)11-6-5-10(17-4)7-12(11)16/h5-7,9,14-16H,8H2,1-4H3/p+1/t9-/m0/s1