[(S)-1,3-benzodioxol-5-yl(pyridin-3-yl)methyl]azanium

Systemtic Name: [(S)-1,3-benzodioxol-5-yl(pyridin-3-yl)methyl]azanium Openeye Name: [(S)-1,3-benzodioxol-5-yl(3-pyridyl)methyl]ammonium CAS Name: [(S)-1,3-benzodioxol-5-yl(3-pyridinyl)methyl]ammonium IUPAC Name: [(S)-1,3-benzodioxol-5-yl(pyridin-3-yl)methyl]azanium Traditional Name: [(S)-1,3-benzodioxol-5-yl(3-pyridyl)methyl]ammonium Formula: C13H13N2O2+ MolecularWeight: 229.25452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O2/c14-13(10-2-1-5-15-7-10)9-3-4-11-12(6-9)17-8-16-11/h1-7,13H,8,14H2/p+1/t13-/m0/s1