3-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-2-methyl-aniline

Systemtic Name: 3-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-2-methyl-aniline Openeye Name: 3-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-2-methyl-aniline CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]-2-methylaniline IUPAC Name: 3-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-2-methylaniline Traditional Name: [3-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-2-methyl-phenyl]amine Formula: C13H22N3O2S+ MolecularWeight: 284.39768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O2S/c1-3-15-7-9-16(10-8-15)19(17,18)13-6-4-5-12(14)11(13)2/h4-6H,3,7-10,14H2,1-2H3/p+1