[(3S)-3-(1,3-benzodioxol-5-yl)-3-chloranyl-propyl]-dimethyl-azanium

Systemtic Name: [(3S)-3-(1,3-benzodioxol-5-yl)-3-chloranyl-propyl]-dimethyl-azanium Openeye Name: [(3S)-3-(1,3-benzodioxol-5-yl)-3-chloro-propyl]-dimethyl-ammonium CAS Name: [(3S)-3-(1,3-benzodioxol-5-yl)-3-chloropropyl]-dimethylammonium IUPAC Name: [(3S)-3-(1,3-benzodioxol-5-yl)-3-chloropropyl]-dimethylazanium Traditional Name: [(3S)-3-(1,3-benzodioxol-5-yl)-3-chloro-propyl]-dimethyl-ammonium Formula: C12H17ClNO2+ MolecularWeight: 242.72188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClNO2/c1-14(2)6-5-10(13)9-3-4-11-12(7-9)16-8-15-11/h3-4,7,10H,5-6,8H2,1-2H3/p+1/t10-/m0/s1