Vitas-M small molecule compound
4-chloro-5-[(3-nitrophenyl)sulfonyl]cyclohexane-1,2-dicarboxylic acid
Catalog ID
STK359129
SMILES ClC1CC(C(=O)O)C(CC1S(=O)(=O)c1cccc(c1)[N+](=O)[O-])C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C14H14ClNO8S MW 391.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14ClNO8S/c15-11-5-9(13(17)18)10(14(19)20)6-12(11)25(23,24)8-3-1-2-7(4-8)16(21)22/h1-4,9-12H,5-6H2,(H,17,18)(H,19,20)InChIKey
LPWQPFFRSHPQJB-UHFFFAOYSA-NSynonyms
4chloro5((3nitrophenyl)sulfonyl)cyclohexane12dicarboxylicacid
4chloro5(3nitrophenyl)sulfonylcyclohexane12dicarboxylicacid
C1C(C(CC(C1S(=O)(=O)C2=CC=CC(=C2)(N+)(=O)(O))Cl)C(=O)O)C(=O)O
ClC1CC(C(=O)O)C(CC1S(=O)(=O)c1cccc(c1)(N+)(=O)(O))C(=O)O
InChI=1SC14H14ClNO8Sc151159(13(17)18)10(14(19)20)612(11)25(2324)83127(48)16(21)22h14912H56H2(H1718)(H1920)
MFCD08532152
ZINC000006668751
ZINC000006668754
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