[2-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methylazanium

Systemtic Name: [2-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methylazanium Openeye Name: [2-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methylammonium CAS Name: [2-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenyl]methylammonium IUPAC Name: [2-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methylazanium Traditional Name: [2-(4-ethylpiperazin-4-ium-1-yl)sulfonylbenzyl]ammonium Formula: C13H23N3O2S+2 MolecularWeight: 285.40562

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C[NH3+]

Isomeric SMILES

CC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C[NH3+]

InChI

InChI=1S/C13H21N3O2S/c1-2-15-7-9-16(10-8-15)19(17,18)13-6-4-3-5-12(13)11-14/h3-6H,2,7-11,14H2,1H3/p+2