[3-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methylazanium

Systemtic Name: [3-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methylazanium Openeye Name: [3-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methylammonium CAS Name: [3-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenyl]methylammonium IUPAC Name: [3-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methylazanium Traditional Name: [3-(4-ethylpiperazin-4-ium-1-yl)sulfonylbenzyl]ammonium Formula: C13H23N3O2S+2 MolecularWeight: 285.40562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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