Vitas-M small molecule compound

dimethyl 2-({[3-(methoxycarbonyl)-5-nitrophenyl]carbonyl}amino)benzene-1,4-dicarboxylate

Catalog ID
STK001204
SMILES COC(=O)c1ccc(c(c1)NC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)OC)C(=O)OC

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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 C19H16N2O9 MW 416.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O9/c1-28-17(23)10-4-5-14(19(25)30-3)15(9-10)20-16(22)11-6-12(18(24)29-2)8-13(7-11)21(26)27/h4-9H,1-3H3,(H,20,22)
InChIKey
GOZBHEJRVBDRMY-UHFFFAOYSA-N
Synonyms
330217-05-5
330217055
COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
COC(=O)c1ccc(c(c1)NC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)OC)C(=O)OC
DIMETHYL2(((3(METHOXYCARBONYL)5NITROPHENYL)CARBONYL)AMINO)BENZENE14DICARBOXYLATE
DIMETHYL2((3(METHOXYCARBONYL)5NITROBENZOYL)AMINO)BENZENE14DICARBOXYLATE
DIMETHYL2((3METHOXYCARBONYL5NITROBENZOYL)AMINO)BENZENE14DICARBOXYLATE
InChI=1SC19H16N2O9c12817(23)104514(19(25)303)15(910)2016(22)11612(18(24)292)813(711)21(26)27h49H13H3(H2022)
METHYL4(METHOXYCARBONYL)2((5(METHOXYCARBONYL)3NITROPHENYL)CARBONYLAMINO)BENZOATE
MFCD01196920
STK001204
ZINC000002930997
ZINC02930997
ZINC2930997

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.