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

Systemtic Name: 1-[(2R,6S)-1-(2-nitrophenyl)sulfonyl-6-[(2R)-2-oxidanylpentyl]piperidin-2-yl]propan-2-one Openeye Name: 1-[(2R,6S)-6-[(2R)-2-hydroxypentyl]-1-(2-nitrophenyl)sulfonyl-2-piperidyl]propan-2-one CAS Name: 1-[(2R,6S)-6-[(2R)-2-hydroxypentyl]-1-(2-nitrophenyl)sulfonyl-2-piperidinyl]-2-propanone IUPAC Name: 1-[(2R,6S)-6-[(2R)-2-hydroxypentyl]-1-(2-nitrophenyl)sulfonylpiperidin-2-yl]propan-2-one Traditional Name: 1-[(2R,6S)-6-[(2R)-2-hydroxypentyl]-1-(2-nitrophenyl)sulfonyl-2-piperidyl]acetone Formula: C19H28N2O6S MolecularWeight: 412.50042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N2O6S/c1-3-7-17(23)13-16-9-6-8-15(12-14(2)22)20(16)28(26,27)19-11-5-4-10-18(19)21(24)25/h4-5,10-11,15-17,23H,3,6-9,12-13H2,1-2H3/t15-,16+,17-/m1/s1