2-[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methylcyclohexyl)ethanamide

Systemtic Name: 2-[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methylcyclohexyl)ethanamide Openeye Name: 2-[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methylcyclohexyl)acetamide CAS Name: 2-[4-(3-bromophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(4-methylcyclohexyl)acetamide IUPAC Name: 2-[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methylcyclohexyl)acetamide Traditional Name: 2-[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-methylcyclohexyl)acetamide Formula: C19H29BrN3O3S+ MolecularWeight: 459.42086

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1CCC(CC1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H28BrN3O3S/c1-15-5-7-17(8-6-15)21-19(24)14-22-9-11-23(12-10-22)27(25,26)18-4-2-3-16(20)13-18/h2-4,13,15,17H,5-12,14H2,1H3,(H,21,24)/p+1