1-(2-piperidin-1-ium-1-ylethyl)-2-propylsulfonyl-benzimidazole

Systemtic Name: 1-(2-piperidin-1-ium-1-ylethyl)-2-propylsulfonyl-benzimidazole Openeye Name: 1-(2-piperidin-1-ium-1-ylethyl)-2-propylsulfonyl-benzimidazole CAS Name: 1-[2-(1-piperidin-1-iumyl)ethyl]-2-propylsulfonylbenzimidazole IUPAC Name: 1-(2-piperidin-1-ium-1-ylethyl)-2-propylsulfonylbenzimidazole Traditional Name: 1-(2-piperidin-1-ium-1-ylethyl)-2-propylsulfonyl-benzimidazole Formula: C17H26N3O2S+ MolecularWeight: 336.47224

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC2=CC=CC=C2N1CC[NH+]3CCCCC3

Isomeric SMILES

CCCS(=O)(=O)C1=NC2=CC=CC=C2N1CC[NH+]3CCCCC3

InChI

InChI=1S/C17H25N3O2S/c1-2-14-23(21,22)17-18-15-8-4-5-9-16(15)20(17)13-12-19-10-6-3-7-11-19/h4-5,8-9H,2-3,6-7,10-14H2,1H3/p+1