3-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propan-1-ol

Systemtic Name: 3-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propan-1-ol Openeye Name: 3-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propan-1-ol CAS Name: 3-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-1-propanol IUPAC Name: 3-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propan-1-ol Traditional Name: 3-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]propan-1-ol Formula: C14H23N2O3S+ MolecularWeight: 299.40902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O3S/c1-15-8-10-16(11-9-15)20(18,19)14-6-4-13(5-7-14)3-2-12-17/h4-7,17H,2-3,8-12H2,1H3/p+1