4-(2,6-dimethylpiperidin-1-yl)sulfonyl-2-nitro-phenol

Systemtic Name: 4-(2,6-dimethylpiperidin-1-yl)sulfonyl-2-nitro-phenol Openeye Name: 4-[(2,6-dimethyl-1-piperidyl)sulfonyl]-2-nitro-phenol CAS Name: 4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]-2-nitrophenol IUPAC Name: 4-(2,6-dimethylpiperidin-1-yl)sulfonyl-2-nitrophenol Traditional Name: 4-(2,6-dimethylpiperidino)sulfonyl-2-nitro-phenol Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])C

InChI

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