[4-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-yl]oxyphenyl]methanol

Systemtic Name: [4-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-yl]oxyphenyl]methanol Openeye Name: [4-[[5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-pyridyl]oxy]phenyl]methanol CAS Name: [4-[[5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2-pyridinyl]oxy]phenyl]methanol IUPAC Name: [4-[5-(4-methylpiperazin-4-ium-1-yl)sulfonylpyridin-2-yl]oxyphenyl]methanol Traditional Name: [4-[[5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2-pyridyl]oxy]phenyl]methanol Formula: C17H22N3O4S+ MolecularWeight: 364.43928

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)OC3=CC=C(C=C3)CO

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CN=C(C=C2)OC3=CC=C(C=C3)CO

InChI

InChI=1S/C17H21N3O4S/c1-19-8-10-20(11-9-19)25(22,23)16-6-7-17(18-12-16)24-15-4-2-14(13-21)3-5-15/h2-7,12,21H,8-11,13H2,1H3/p+1