[(1S)-1-(1,3-benzodioxol-5-yl)-2-phenethyloxy-ethyl]azanium

Systemtic Name: [(1S)-1-(1,3-benzodioxol-5-yl)-2-phenethyloxy-ethyl]azanium Openeye Name: [(1S)-1-(1,3-benzodioxol-5-yl)-2-phenethyloxy-ethyl]ammonium CAS Name: [(1S)-1-(1,3-benzodioxol-5-yl)-2-phenethyloxyethyl]ammonium IUPAC Name: [(1S)-1-(1,3-benzodioxol-5-yl)-2-phenethyloxyethyl]azanium Traditional Name: [(1S)-1-(1,3-benzodioxol-5-yl)-2-phenethyloxy-ethyl]ammonium Formula: C17H20NO3+ MolecularWeight: 286.3456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(COCCC3=CC=CC=C3)[NH3+]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)[C@@H](COCCC3=CC=CC=C3)[NH3+]

InChI

InChI=1S/C17H19NO3/c18-15(11-19-9-8-13-4-2-1-3-5-13)14-6-7-16-17(10-14)21-12-20-16/h1-7,10,15H,8-9,11-12,18H2/p+1/t15-/m1/s1