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

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-3-ol Openeye Name: 1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-3-ol CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-3-piperidinol IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonylpiperidin-3-ol Traditional Name: 1-(2-methyl-5-nitro-phenyl)sulfonylpiperidin-3-ol Formula: C12H16N2O5S MolecularWeight: 300.33084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC(C2)O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCCC(C2)O

InChI

InChI=1S/C12H16N2O5S/c1-9-4-5-10(14(16)17)7-12(9)20(18,19)13-6-2-3-11(15)8-13/h4-5,7,11,15H,2-3,6,8H2,1H3