[(2R)-2-(1,3-benzodioxol-5-yl)-2-oxidanyl-ethyl]-propyl-azanium

Systemtic Name: [(2R)-2-(1,3-benzodioxol-5-yl)-2-oxidanyl-ethyl]-propyl-azanium Openeye Name: [(2R)-2-(1,3-benzodioxol-5-yl)-2-hydroxy-ethyl]-propyl-ammonium CAS Name: [(2R)-2-(1,3-benzodioxol-5-yl)-2-hydroxyethyl]-propylammonium IUPAC Name: [(2R)-2-(1,3-benzodioxol-5-yl)-2-hydroxyethyl]-propylazanium Traditional Name: [(2R)-2-(1,3-benzodioxol-5-yl)-2-hydroxy-ethyl]-propyl-ammonium Formula: C12H18NO3+ MolecularWeight: 224.27622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO3/c1-2-5-13-7-10(14)9-3-4-11-12(6-9)16-8-15-11/h3-4,6,10,13-14H,2,5,7-8H2,1H3/p+1/t10-/m0/s1