[(1S)-1-[3-methoxy-4-(2-methylpropoxy)phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[3-methoxy-4-(2-methylpropoxy)phenyl]ethyl]azanium Openeye Name: [(1S)-1-(4-isobutoxy-3-methoxy-phenyl)ethyl]ammonium CAS Name: [(1S)-1-[3-methoxy-4-(2-methylpropoxy)phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[3-methoxy-4-(2-methylpropoxy)phenyl]ethyl]azanium Traditional Name: [(1S)-1-(4-isobutoxy-3-methoxy-phenyl)ethyl]ammonium Formula: C13H22NO2+ MolecularWeight: 224.31928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(C)[NH3+])OC

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO2/c1-9(2)8-16-12-6-5-11(10(3)14)7-13(12)15-4/h5-7,9-10H,8,14H2,1-4H3/p+1/t10-/m0/s1