N-ethyl-4-piperazin-4-ium-1-ylsulfonyl-benzamide

Systemtic Name: N-ethyl-4-piperazin-4-ium-1-ylsulfonyl-benzamide Openeye Name: N-ethyl-4-piperazin-4-ium-1-ylsulfonyl-benzamide CAS Name: N-ethyl-4-(1-piperazin-4-iumylsulfonyl)benzamide IUPAC Name: N-ethyl-4-piperazin-4-ium-1-ylsulfonylbenzamide Traditional Name: N-ethyl-4-piperazin-4-ium-1-ylsulfonyl-benzamide Formula: C13H20N3O3S+ MolecularWeight: 298.3812

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C13H19N3O3S/c1-2-15-13(17)11-3-5-12(6-4-11)20(18,19)16-9-7-14-8-10-16/h3-6,14H,2,7-10H2,1H3,(H,15,17)/p+1