4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenol

Systemtic Name: 4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenol Openeye Name: 4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenol CAS Name: 4-[(4-ethyl-1-piperazin-4-iumyl)sulfonyl]phenol IUPAC Name: 4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenol Traditional Name: 4-(4-ethylpiperazin-4-ium-1-yl)sulfonylphenol Formula: C12H19N2O3S+ MolecularWeight: 271.35586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O3S/c1-2-13-7-9-14(10-8-13)18(16,17)12-5-3-11(15)4-6-12/h3-6,15H,2,7-10H2,1H3/p+1