[4-(1,3-benzodioxol-5-yl)-4-oxidanylidene-butyl]-dimethyl-azanium chloride

Systemtic Name: [4-(1,3-benzodioxol-5-yl)-4-oxidanylidene-butyl]-dimethyl-azanium chloride Openeye Name: [4-(1,3-benzodioxol-5-yl)-4-oxo-butyl]-dimethyl-ammonium chloride CAS Name: [4-(1,3-benzodioxol-5-yl)-4-oxobutyl]-dimethylammonium chloride IUPAC Name: [4-(1,3-benzodioxol-5-yl)-4-oxobutyl]-dimethylazanium chloride Traditional Name: [4-(1,3-benzodioxol-5-yl)-4-keto-butyl]-dimethyl-ammonium chloride Formula: C13H18ClNO3 MolecularWeight: 271.73992

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCC(=O)C1=CC2=C(C=C1)OCO2.[Cl-]

Isomeric SMILES

C[NH+](C)CCCC(=O)C1=CC2=C(C=C1)OCO2.[Cl-]

InChI

InChI=1S/C13H17NO3.ClH/c1-14(2)7-3-4-11(15)10-5-6-12-13(8-10)17-9-16-12;/h5-6,8H,3-4,7,9H2,1-2H3;1H