N-[2,5-bis(chloranyl)phenyl]-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-benzenesulfonamide

Systemtic Name: N-[2,5-bis(chloranyl)phenyl]-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-benzenesulfonamide Openeye Name: N-(2,5-dichlorophenyl)-3-(4-methylpiperazin-4-ium-1-carbonyl)benzenesulfonamide CAS Name: N-(2,5-dichlorophenyl)-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]benzenesulfonamide IUPAC Name: N-(2,5-dichlorophenyl)-3-(4-methylpiperazin-4-ium-1-carbonyl)benzenesulfonamide Traditional Name: N-(2,5-dichlorophenyl)-3-(4-methylpiperazin-4-ium-1-carbonyl)benzenesulfonamide Formula: C18H20Cl2N3O3S+ MolecularWeight: 429.3407

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C18H19Cl2N3O3S/c1-22-7-9-23(10-8-22)18(24)13-3-2-4-15(11-13)27(25,26)21-17-12-14(19)5-6-16(17)20/h2-6,11-12,21H,7-10H2,1H3/p+1