[1-[(3,4-dichlorophenyl)methylsulfonyl]piperidin-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [1-[(3,4-dichlorophenyl)methylsulfonyl]piperidin-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [1-[(3,4-dichlorophenyl)methylsulfonyl]-4-piperidyl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [1-[(3,4-dichlorophenyl)methylsulfonyl]-4-piperidinyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [1-[(3,4-dichlorophenyl)methylsulfonyl]piperidin-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [1-(3,4-dichlorobenzyl)sulfonyl-4-piperidyl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C18H26Cl2N3O3S+ MolecularWeight: 435.38834

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H25Cl2N3O3S/c1-21-8-10-22(11-9-21)18(24)15-4-6-23(7-5-15)27(25,26)13-14-2-3-16(19)17(20)12-14/h2-3,12,15H,4-11,13H2,1H3/p+1