3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenol

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenol Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenol CAS Name: 3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenol IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenol Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonylphenol Formula: C11H17N2O3S+ MolecularWeight: 257.32928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O3S/c1-12-5-7-13(8-6-12)17(15,16)11-4-2-3-10(14)9-11/h2-4,9,14H,5-8H2,1H3/p+1