4-chloranyl-N-(4-methylpiperazin-4-ium-1-yl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-(4-methylpiperazin-4-ium-1-yl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-(4-methylpiperazin-4-ium-1-yl)-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-chloro-N-(4-methyl-1-piperazin-4-iumyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-(4-methylpiperazin-4-ium-1-yl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-(4-methylpiperazin-4-ium-1-yl)-3-piperidinosulfonyl-benzamide Formula: C17H26ClN4O3S+ MolecularWeight: 401.93134

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C17H25ClN4O3S/c1-20-9-11-21(12-10-20)19-17(23)14-5-6-15(18)16(13-14)26(24,25)22-7-3-2-4-8-22/h5-6,13H,2-4,7-12H2,1H3,(H,19,23)/p+1