[(2S)-2-(4-methoxy-3-propan-2-yloxy-phenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: [(2S)-2-(4-methoxy-3-propan-2-yloxy-phenyl)-2-oxidanyl-ethyl]azanium Openeye Name: [(2S)-2-hydroxy-2-(3-isopropoxy-4-methoxy-phenyl)ethyl]ammonium CAS Name: [(2S)-2-hydroxy-2-(4-methoxy-3-propan-2-yloxyphenyl)ethyl]ammonium IUPAC Name: [(2S)-2-hydroxy-2-(4-methoxy-3-propan-2-yloxyphenyl)ethyl]azanium Traditional Name: [(2S)-2-hydroxy-2-(3-isopropoxy-4-methoxy-phenyl)ethyl]ammonium Formula: C12H20NO3+ MolecularWeight: 226.2921

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=CC(=C1)C(C[NH3+])O)OC

Isomeric SMILES

CC(C)OC1=C(C=CC(=C1)[C@@H](C[NH3+])O)OC

InChI

InChI=1S/C12H19NO3/c1-8(2)16-12-6-9(10(14)7-13)4-5-11(12)15-3/h4-6,8,10,14H,7,13H2,1-3H3/p+1/t10-/m1/s1