Vitas-M small molecule compound
dimethyl 5-{[(5-chloro-2-nitrophenyl)carbonyl]amino}benzene-1,3-dicarboxylate
Catalog ID
STK427772
SMILES COC(=O)c1cc(cc(c1)C(=O)OC)NC(=O)c1cc(Cl)ccc1[N+](=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 C17H13ClN2O7 MW 392.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN2O7/c1-26-16(22)9-5-10(17(23)27-2)7-12(6-9)19-15(21)13-8-11(18)3-4-14(13)20(24)25/h3-8H,1-2H3,(H,19,21)InChIKey
ORHCKKBAYSNNFG-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC(=CC(=C1)NC(=O)C2=C(C=CC(=C2)Cl)(N+)(=O)(O))C(=O)OC
COC(=O)c1cc(cc(c1)C(=O)OC)NC(=O)c1cc(Cl)ccc1(N+)(=O)(O)
dimethyl5(((5chloro2nitrophenyl)carbonyl)amino)benzene13dicarboxylate
DIMETHYL5((5CHLORO2NITROBENZOYL)AMINO)BENZENE13DICARBOXYLATE
InChI=1SC17H13ClN2O7c12616(22)9510(17(23)272)712(69)1915(21)13811(18)3414(13)20(24)25h38H12H3(H1921)
METHYL5((5CHLORO2NITROPHENYL)CARBONYLAMINO)3(METHOXYCARBONYL)BENZOATE
MFCD01337862
ZINC000001200689
ZINC01200689
ZINC1200689
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