1-(4-chlorophenyl)sulfonyl-4-pentan-3-yl-piperazin-4-ium

Systemtic Name: 1-(4-chlorophenyl)sulfonyl-4-pentan-3-yl-piperazin-4-ium Openeye Name: 1-(4-chlorophenyl)sulfonyl-4-(1-ethylpropyl)piperazin-4-ium CAS Name: 1-(4-chlorophenyl)sulfonyl-4-pentan-3-ylpiperazin-4-ium IUPAC Name: 1-(4-chlorophenyl)sulfonyl-4-pentan-3-ylpiperazin-4-ium Traditional Name: 1-(4-chlorophenyl)sulfonyl-4-(1-ethylpropyl)piperazin-4-ium Formula: C15H24ClN2O2S+ MolecularWeight: 331.88126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(CC)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H23ClN2O2S/c1-3-14(4-2)17-9-11-18(12-10-17)21(19,20)15-7-5-13(16)6-8-15/h5-8,14H,3-4,9-12H2,1-2H3/p+1