1-(3-chloranyl-4-methyl-phenyl)sulfonyl-4-propan-2-yl-piperazin-4-ium

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)sulfonyl-4-propan-2-yl-piperazin-4-ium Openeye Name: 1-(3-chloro-4-methyl-phenyl)sulfonyl-4-isopropyl-piperazin-4-ium CAS Name: 1-(3-chloro-4-methylphenyl)sulfonyl-4-propan-2-ylpiperazin-4-ium IUPAC Name: 1-(3-chloro-4-methylphenyl)sulfonyl-4-propan-2-ylpiperazin-4-ium Traditional Name: 1-(3-chloro-4-methyl-phenyl)sulfonyl-4-isopropyl-piperazin-4-ium Formula: C14H22ClN2O2S+ MolecularWeight: 317.85468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C(C)C)Cl

InChI

InChI=1S/C14H21ClN2O2S/c1-11(2)16-6-8-17(9-7-16)20(18,19)13-5-4-12(3)14(15)10-13/h4-5,10-11H,6-9H2,1-3H3/p+1