1-[(2R,6R)-6-methyl-1-(2-nitrophenyl)sulfonyl-piperidin-2-yl]propan-2-one

Systemtic Name: 1-[(2R,6R)-6-methyl-1-(2-nitrophenyl)sulfonyl-piperidin-2-yl]propan-2-one Openeye Name: 1-[(2R,6R)-6-methyl-1-(2-nitrophenyl)sulfonyl-2-piperidyl]propan-2-one CAS Name: 1-[(2R,6R)-6-methyl-1-(2-nitrophenyl)sulfonyl-2-piperidinyl]-2-propanone IUPAC Name: 1-[(2R,6R)-6-methyl-1-(2-nitrophenyl)sulfonylpiperidin-2-yl]propan-2-one Traditional Name: 1-[(2R,6R)-6-methyl-1-(2-nitrophenyl)sulfonyl-2-piperidyl]acetone Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H]1CCC[C@@H](N1S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])CC(=O)C

InChI

InChI=1S/C15H20N2O5S/c1-11-6-5-7-13(10-12(2)18)16(11)23(21,22)15-9-4-3-8-14(15)17(19)20/h3-4,8-9,11,13H,5-7,10H2,1-2H3/t11-,13-/m1/s1