[(1S)-1-(3-methoxy-4-oxidanyl-phenyl)ethyl]-propan-2-yl-azanium

Systemtic Name: [(1S)-1-(3-methoxy-4-oxidanyl-phenyl)ethyl]-propan-2-yl-azanium Openeye Name: [(1S)-1-(4-hydroxy-3-methoxy-phenyl)ethyl]-isopropyl-ammonium CAS Name: [(1S)-1-(4-hydroxy-3-methoxyphenyl)ethyl]-propan-2-ylammonium IUPAC Name: [(1S)-1-(4-hydroxy-3-methoxyphenyl)ethyl]-propan-2-ylazanium Traditional Name: [(1S)-1-(4-hydroxy-3-methoxy-phenyl)ethyl]-isopropyl-ammonium Formula: C12H20NO2+ MolecularWeight: 210.2927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO2/c1-8(2)13-9(3)10-5-6-11(14)12(7-10)15-4/h5-9,13-14H,1-4H3/p+1/t9-/m0/s1