4-chloranyl-N-[3-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[3-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: 4-chloro-N-[3-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxo-propyl]benzenesulfonamide CAS Name: 4-chloro-N-[3-[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[3-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxopropyl]benzenesulfonamide Traditional Name: 4-chloro-N-[3-[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]-3-keto-propyl]benzenesulfonamide Formula: C20H24Cl2N3O3S+ MolecularWeight: 457.39386

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)Cl)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)Cl)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23Cl2N3O3S/c21-17-3-1-16(2-4-17)15-24-11-13-25(14-12-24)20(26)9-10-23-29(27,28)19-7-5-18(22)6-8-19/h1-8,23H,9-15H2/p+1