1-(2-morpholin-2-yl-5-nitro-phenyl)sulfonylethanol

Systemtic Name: 1-(2-morpholin-2-yl-5-nitro-phenyl)sulfonylethanol Openeye Name: 1-(2-morpholin-2-yl-5-nitro-phenyl)sulfonylethanol CAS Name: 1-[2-(2-morpholinyl)-5-nitrophenyl]sulfonylethanol IUPAC Name: 1-(2-morpholin-2-yl-5-nitrophenyl)sulfonylethanol Traditional Name: 1-(2-morpholin-2-yl-5-nitro-phenyl)sulfonylethanol Formula: C12H16N2O6S MolecularWeight: 316.33024

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Descriptors Computed from Structure

Canonical SMILES:

CC(O)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])C2CNCCO2

Isomeric SMILES

CC(O)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])C2CNCCO2

InChI

InChI=1S/C12H16N2O6S/c1-8(15)21(18,19)12-6-9(14(16)17)2-3-10(12)11-7-13-4-5-20-11/h2-3,6,8,11,13,15H,4-5,7H2,1H3