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

Systemtic Name: [(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-(3-oxidanylpropyl)azanium Openeye Name: [(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-(3-hydroxypropyl)ammonium CAS Name: [(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-(3-hydroxypropyl)ammonium IUPAC Name: [(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-(3-hydroxypropyl)azanium Traditional Name: [(1S)-1-(1,3-benzodioxol-5-yl)ethyl]-(3-hydroxypropyl)ammonium Formula: C12H18NO3+ MolecularWeight: 224.27622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)[NH2+]CCCO

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCO2)[NH2+]CCCO

InChI

InChI=1S/C12H17NO3/c1-9(13-5-2-6-14)10-3-4-11-12(7-10)16-8-15-11/h3-4,7,9,13-14H,2,5-6,8H2,1H3/p+1/t9-/m0/s1