[(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-propyl-azanium

Systemtic Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-propyl-azanium Openeye Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-propyl-ammonium CAS Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-propylammonium IUPAC Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-propylazanium Traditional Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-propyl-ammonium Formula: C14H22NO2+ MolecularWeight: 236.32998

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]C(C)CCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCC[NH2+][C@H](C)CCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C14H21NO2/c1-3-8-15-11(2)4-5-12-6-7-13-14(9-12)17-10-16-13/h6-7,9,11,15H,3-5,8,10H2,1-2H3/p+1/t11-/m1/s1