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

Systemtic Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-butyl-azanium Openeye Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-butyl-ammonium CAS Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-butylammonium IUPAC Name: [(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]-butylazanium Traditional Name: [(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]-butyl-ammonium Formula: C15H24NO2+ MolecularWeight: 250.35656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23NO2/c1-3-4-9-16-12(2)5-6-13-7-8-14-15(10-13)18-11-17-14/h7-8,10,12,16H,3-6,9,11H2,1-2H3/p+1/t12-/m1/s1