1,3-benzodioxol-5-ylmethyl-[2-[2,5-bis(chloranyl)phenyl]sulfonylethyl]-methyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[2-[2,5-bis(chloranyl)phenyl]sulfonylethyl]-methyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-(2,5-dichlorophenyl)sulfonylethyl]-methyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-(2,5-dichlorophenyl)sulfonylethyl]-methylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-(2,5-dichlorophenyl)sulfonylethyl]-methylazanium Traditional Name: 2-(2,5-dichlorophenyl)sulfonylethyl-methyl-piperonyl-ammonium Formula: C17H18Cl2NO4S+ MolecularWeight: 403.30012

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCS(=O)(=O)C1=C(C=CC(=C1)Cl)Cl)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[NH+](CCS(=O)(=O)C1=C(C=CC(=C1)Cl)Cl)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H17Cl2NO4S/c1-20(10-12-2-5-15-16(8-12)24-11-23-15)6-7-25(21,22)17-9-13(18)3-4-14(17)19/h2-5,8-9H,6-7,10-11H2,1H3/p+1