[(3S)-3-azaniumyl-3-(1,3-benzodioxol-5-yl)propyl]-diethyl-azanium

Systemtic Name: [(3S)-3-azaniumyl-3-(1,3-benzodioxol-5-yl)propyl]-diethyl-azanium Openeye Name: [(3S)-3-azaniumyl-3-(1,3-benzodioxol-5-yl)propyl]-diethyl-ammonium CAS Name: [(3S)-3-ammonio-3-(1,3-benzodioxol-5-yl)propyl]-diethylammonium IUPAC Name: [(3S)-3-azaniumyl-3-(1,3-benzodioxol-5-yl)propyl]-diethylazanium Traditional Name: [(3S)-3-ammonio-3-(1,3-benzodioxol-5-yl)propyl]-diethyl-ammonium Formula: C14H24N2O2+2 MolecularWeight: 252.35256

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC(C1=CC2=C(C=C1)OCO2)[NH3+]

Isomeric SMILES

CC[NH+](CC)CC[C@@H](C1=CC2=C(C=C1)OCO2)[NH3+]

InChI

InChI=1S/C14H22N2O2/c1-3-16(4-2)8-7-12(15)11-5-6-13-14(9-11)18-10-17-13/h5-6,9,12H,3-4,7-8,10,15H2,1-2H3/p+2/t12-/m0/s1