2-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanol

Systemtic Name: 2-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanol Openeye Name: 2-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanol CAS Name: 2-[4-(4-methyl-3-nitrophenyl)sulfonyl-1-piperazinyl]ethanol IUPAC Name: 2-[4-(4-methyl-3-nitrophenyl)sulfonylpiperazin-1-yl]ethanol Traditional Name: 2-[4-(4-methyl-3-nitro-phenyl)sulfonylpiperazino]ethanol Formula: C13H19N3O5S MolecularWeight: 329.37206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CCO)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CCO)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O5S/c1-11-2-3-12(10-13(11)16(18)19)22(20,21)15-6-4-14(5-7-15)8-9-17/h2-3,10,17H,4-9H2,1H3