3-(4-cyclohexylpiperazin-4-ium-1-yl)sulfonyl-N-(3,4-dichlorophenyl)-4-fluoranyl-benzamide

Systemtic Name: 3-(4-cyclohexylpiperazin-4-ium-1-yl)sulfonyl-N-(3,4-dichlorophenyl)-4-fluoranyl-benzamide Openeye Name: 3-(4-cyclohexylpiperazin-4-ium-1-yl)sulfonyl-N-(3,4-dichlorophenyl)-4-fluoro-benzamide CAS Name: 3-[(4-cyclohexyl-1-piperazin-4-iumyl)sulfonyl]-N-(3,4-dichlorophenyl)-4-fluorobenzamide IUPAC Name: 3-(4-cyclohexylpiperazin-4-ium-1-yl)sulfonyl-N-(3,4-dichlorophenyl)-4-fluorobenzamide Traditional Name: 3-(4-cyclohexylpiperazin-4-ium-1-yl)sulfonyl-N-(3,4-dichlorophenyl)-4-fluoro-benzamide Formula: C23H27Cl2FN3O3S+ MolecularWeight: 515.448183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC(=C(C=C4)Cl)Cl)F

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC(=C(C=C4)Cl)Cl)F

InChI

InChI=1S/C23H26Cl2FN3O3S/c24-19-8-7-17(15-20(19)25)27-23(30)16-6-9-21(26)22(14-16)33(31,32)29-12-10-28(11-13-29)18-4-2-1-3-5-18/h6-9,14-15,18H,1-5,10-13H2,(H,27,30)/p+1