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

Systemtic Name: [(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-propan-2-yl-azanium Openeye Name: [(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-isopropyl-ammonium CAS Name: [(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-propan-2-ylammonium IUPAC Name: [(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-propan-2-ylazanium Traditional Name: [(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-isopropyl-ammonium Formula: C12H18NO2+ MolecularWeight: 208.27682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO2/c1-8(2)13-9(3)10-4-5-11-12(6-10)15-7-14-11/h4-6,8-9,13H,7H2,1-3H3/p+1/t9-/m1/s1