2-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethylazanium

Systemtic Name: 2-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethylazanium Openeye Name: 2-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethylammonium CAS Name: 2-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]ethylammonium IUPAC Name: 2-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethylazanium Traditional Name: 2-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]ethylammonium Formula: C13H23N3O2S+2 MolecularWeight: 285.40562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O2S/c1-15-8-10-16(11-9-15)19(17,18)13-4-2-12(3-5-13)6-7-14/h2-5H,6-11,14H2,1H3/p+2