1-(2-fluoranylphenoxy)-3-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]propan-2-ol

Systemtic Name: 1-(2-fluoranylphenoxy)-3-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]propan-2-ol Openeye Name: 1-(2-fluorophenoxy)-3-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]propan-2-ol CAS Name: 1-(2-fluorophenoxy)-3-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-2-propanol IUPAC Name: 1-(2-fluorophenoxy)-3-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]propan-2-ol Traditional Name: 1-(2-fluorophenoxy)-3-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]propan-2-ol Formula: C20H24FN3O6S MolecularWeight: 453.484463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC(COC3=CC=CC=C3F)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CC(COC3=CC=CC=C3F)O

InChI

InChI=1S/C20H24FN3O6S/c1-15-6-7-16(24(26)27)12-20(15)31(28,29)23-10-8-22(9-11-23)13-17(25)14-30-19-5-3-2-4-18(19)21/h2-7,12,17,25H,8-11,13-14H2,1H3