[(1R,2S)-2-(1,3-benzodioxol-5-yloxy)-1-(4-methylphenyl)propyl]azanium

Systemtic Name: [(1R,2S)-2-(1,3-benzodioxol-5-yloxy)-1-(4-methylphenyl)propyl]azanium Openeye Name: [(1R,2S)-2-(1,3-benzodioxol-5-yloxy)-1-(p-tolyl)propyl]ammonium CAS Name: [(1R,2S)-2-(1,3-benzodioxol-5-yloxy)-1-(4-methylphenyl)propyl]ammonium IUPAC Name: [(1R,2S)-2-(1,3-benzodioxol-5-yloxy)-1-(4-methylphenyl)propyl]azanium Traditional Name: [(1R,2S)-2-(1,3-benzodioxol-5-yloxy)-1-(p-tolyl)propyl]ammonium Formula: C17H20NO3+ MolecularWeight: 286.3456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C)OC2=CC3=C(C=C2)OCO3)[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]([C@H](C)OC2=CC3=C(C=C2)OCO3)[NH3+]

InChI

InChI=1S/C17H19NO3/c1-11-3-5-13(6-4-11)17(18)12(2)21-14-7-8-15-16(9-14)20-10-19-15/h3-9,12,17H,10,18H2,1-2H3/p+1/t12-,17-/m0/s1