2-[4-[2,3-bis(chloranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]-N-cycloheptyl-ethanamide

Systemtic Name: 2-[4-[2,3-bis(chloranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]-N-cycloheptyl-ethanamide Openeye Name: N-cycloheptyl-2-[4-(2,3-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-cycloheptyl-2-[4-(2,3-dichlorophenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cycloheptyl-2-[4-(2,3-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-cycloheptyl-2-[4-(2,3-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C19H28Cl2N3O3S+ MolecularWeight: 449.41492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C1CCCC(CC1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C19H27Cl2N3O3S/c20-16-8-5-9-17(19(16)21)28(26,27)24-12-10-23(11-13-24)14-18(25)22-15-6-3-1-2-4-7-15/h5,8-9,15H,1-4,6-7,10-14H2,(H,22,25)/p+1