[(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-(3-imidazol-1-ylpropyl)azanium Openeye Name: [(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-(3-imidazol-1-ylpropyl)ammonium CAS Name: [(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-(3-imidazol-1-ylpropyl)azanium Traditional Name: [(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C15H20N3O2+ MolecularWeight: 274.3382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)[NH2+]CCCN3C=CN=C3

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCO2)[NH2+]CCCN3C=CN=C3

InChI

InChI=1S/C15H19N3O2/c1-12(17-5-2-7-18-8-6-16-10-18)13-3-4-14-15(9-13)20-11-19-14/h3-4,6,8-10,12,17H,2,5,7,11H2,1H3/p+1/t12-/m0/s1