N-(2-piperazin-4-ium-1-ylsulfonylethyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-(2-piperazin-4-ium-1-ylsulfonylethyl)-1,3-benzodioxole-5-carboxamide Openeye Name: N-(2-piperazin-4-ium-1-ylsulfonylethyl)-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-(1-piperazin-4-iumylsulfonyl)ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-(2-piperazin-4-ium-1-ylsulfonylethyl)-1,3-benzodioxole-5-carboxamide Traditional Name: N-(2-piperazin-4-ium-1-ylsulfonylethyl)-piperonylamide Formula: C14H20N3O5S+ MolecularWeight: 342.3907

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)CCNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)CCNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H19N3O5S/c18-14(11-1-2-12-13(9-11)22-10-21-12)16-5-8-23(19,20)17-6-3-15-4-7-17/h1-2,9,15H,3-8,10H2,(H,16,18)/p+1