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

Systemtic Name: ethyl-[[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methyl]azanium Openeye Name: ethyl-[[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methyl]ammonium CAS Name: ethyl-[[4-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenyl]methyl]ammonium IUPAC Name: ethyl-[[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]methyl]azanium Traditional Name: ethyl-[4-(4-ethylpiperazin-4-ium-1-yl)sulfonylbenzyl]ammonium Formula: C15H27N3O2S+2 MolecularWeight: 313.45878

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC

Isomeric SMILES

CC[NH2+]CC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC

InChI

InChI=1S/C15H25N3O2S/c1-3-16-13-14-5-7-15(8-6-14)21(19,20)18-11-9-17(4-2)10-12-18/h5-8,16H,3-4,9-13H2,1-2H3/p+2