2-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-aniline

Systemtic Name: 2-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-aniline Openeye Name: 2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-aniline CAS Name: 2-chloro-5-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]aniline IUPAC Name: 2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonylaniline Traditional Name: [2-chloro-5-(4-ethylpiperazin-4-ium-1-yl)sulfonyl-phenyl]amine Formula: C12H19ClN3O2S+ MolecularWeight: 304.81616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18ClN3O2S/c1-2-15-5-7-16(8-6-15)19(17,18)10-3-4-11(13)12(14)9-10/h3-4,9H,2,5-8,14H2,1H3/p+1