1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-3-ol

Systemtic Name: 1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-3-ol Openeye Name: 1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-3-ol CAS Name: 1-(2-methoxy-5-nitrophenyl)sulfonyl-3-piperidinol IUPAC Name: 1-(2-methoxy-5-nitrophenyl)sulfonylpiperidin-3-ol Traditional Name: 1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-3-ol Formula: C12H16N2O6S MolecularWeight: 316.33024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC(C2)O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC(C2)O

InChI

InChI=1S/C12H16N2O6S/c1-20-11-5-4-9(14(16)17)7-12(11)21(18,19)13-6-2-3-10(15)8-13/h4-5,7,10,15H,2-3,6,8H2,1H3