5-methoxy-2-(4-methylpiperazin-4-ium-1-yl)sulfonyl-aniline

Systemtic Name: 5-methoxy-2-(4-methylpiperazin-4-ium-1-yl)sulfonyl-aniline Openeye Name: 5-methoxy-2-(4-methylpiperazin-4-ium-1-yl)sulfonyl-aniline CAS Name: 5-methoxy-2-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]aniline IUPAC Name: 5-methoxy-2-(4-methylpiperazin-4-ium-1-yl)sulfonylaniline Traditional Name: [5-methoxy-2-(4-methylpiperazin-4-ium-1-yl)sulfonyl-phenyl]amine Formula: C12H20N3O3S+ MolecularWeight: 286.3705

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19N3O3S/c1-14-5-7-15(8-6-14)19(16,17)12-4-3-10(18-2)9-11(12)13/h3-4,9H,5-8,13H2,1-2H3/p+1