3-(4-ethylpiperazin-4-ium-1-yl)sulfonylaniline

Systemtic Name: 3-(4-ethylpiperazin-4-ium-1-yl)sulfonylaniline Openeye Name: 3-(4-ethylpiperazin-4-ium-1-yl)sulfonylaniline CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]aniline IUPAC Name: 3-(4-ethylpiperazin-4-ium-1-yl)sulfonylaniline Traditional Name: [3-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenyl]amine Formula: C12H20N3O2S+ MolecularWeight: 270.3711

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N3O2S/c1-2-14-6-8-15(9-7-14)18(16,17)12-5-3-4-11(13)10-12/h3-5,10H,2,6-9,13H2,1H3/p+1