1-(3,4-dimethyl-5-nitro-phenyl)sulfonylpiperidin-3-ol

Systemtic Name: 1-(3,4-dimethyl-5-nitro-phenyl)sulfonylpiperidin-3-ol Openeye Name: 1-(3,4-dimethyl-5-nitro-phenyl)sulfonylpiperidin-3-ol CAS Name: 1-(3,4-dimethyl-5-nitrophenyl)sulfonyl-3-piperidinol IUPAC Name: 1-(3,4-dimethyl-5-nitrophenyl)sulfonylpiperidin-3-ol Traditional Name: 1-(3,4-dimethyl-5-nitro-phenyl)sulfonylpiperidin-3-ol Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)[N+](=O)[O-])S(=O)(=O)N2CCCC(C2)O

Isomeric SMILES

CC1=CC(=CC(=C1C)[N+](=O)[O-])S(=O)(=O)N2CCCC(C2)O

InChI

InChI=1S/C13H18N2O5S/c1-9-6-12(7-13(10(9)2)15(17)18)21(19,20)14-5-3-4-11(16)8-14/h6-7,11,16H,3-5,8H2,1-2H3