3-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propylazanium

Systemtic Name: 3-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propylazanium Openeye Name: 3-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propylammonium CAS Name: 3-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]propylammonium IUPAC Name: 3-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propylazanium Traditional Name: 3-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propylammonium Formula: C14H25N3O2S+2 MolecularWeight: 299.4322

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC[NH3+]

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC[NH3+]

InChI

InChI=1S/C14H23N3O2S/c1-16-9-11-17(12-10-16)20(18,19)14-6-4-13(5-7-14)3-2-8-15/h4-7H,2-3,8-12,15H2,1H3/p+2