N-[2,5-bis(chloranyl)phenyl]-2-[4-(oxan-4-ylsulfonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2,5-bis(chloranyl)phenyl]-2-[4-(oxan-4-ylsulfonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,5-dichlorophenyl)-2-(4-tetrahydropyran-4-ylsulfonylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(2,5-dichlorophenyl)-2-[4-(4-oxanylsulfonyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,5-dichlorophenyl)-2-[4-(oxan-4-ylsulfonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,5-dichlorophenyl)-2-(4-tetrahydropyran-4-ylsulfonylpiperazin-1-ium-1-yl)acetamide Formula: C17H24Cl2N3O4S+ MolecularWeight: 437.36116

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

C1COCCC1S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C17H23Cl2N3O4S/c18-13-1-2-15(19)16(11-13)20-17(23)12-21-5-7-22(8-6-21)27(24,25)14-3-9-26-10-4-14/h1-2,11,14H,3-10,12H2,(H,20,23)/p+1