[(1S)-1-[3-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[3-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]ethyl]azanium Openeye Name: [(1S)-1-[3-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]ethyl]ammonium CAS Name: [(1S)-1-[3-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[3-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]ethyl]azanium Traditional Name: [(1S)-1-[3-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]ethyl]ammonium Formula: C14H25N3O2S+2 MolecularWeight: 299.4322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23N3O2S/c1-3-16-7-9-17(10-8-16)20(18,19)14-6-4-5-13(11-14)12(2)15/h4-6,11-12H,3,7-10,15H2,1-2H3/p+2/t12-/m0/s1