N-(4-bromophenyl)-2-(4-cyclohexylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-bromophenyl)-2-(4-cyclohexylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(4-bromophenyl)-2-(4-cyclohexylsulfonylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(4-bromophenyl)-2-(4-cyclohexylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(4-bromophenyl)-2-(4-cyclohexylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(4-bromophenyl)-2-(4-cyclohexylsulfonylpiperazin-1-ium-1-yl)acetamide Formula: C18H27BrN3O3S+ MolecularWeight: 445.39428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCC(CC1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H26BrN3O3S/c19-15-6-8-16(9-7-15)20-18(23)14-21-10-12-22(13-11-21)26(24,25)17-4-2-1-3-5-17/h6-9,17H,1-5,10-14H2,(H,20,23)/p+1