Vitas-M small molecule compound

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

Catalog ID
STK053849
SMILES COC(=O)c1ccc(cc1NC(=O)c1ccc(c(c1)[N+](=O)[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 C18H16N2O8 MW 388.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O8/c1-26-15-7-5-10(9-14(15)20(24)25)16(21)19-13-8-11(17(22)27-2)4-6-12(13)18(23)28-3/h4-9H,1-3H3,(H,19,21)
InChIKey
DNBIZAYCOTVFIS-UHFFFAOYSA-N
Synonyms
328259-30-9
2(4METHOXY3NITROBENZOYLAMINO)TEREPHTHALICACIDDIMETHYLESTER
328259309
BENZENE14DICARBOXYLICACID2(4METHOXY3NITROBENZOYLAMINO)DIMETHYLESTER
COC(=O)c1ccc(cc1NC(=O)c1ccc(c(c1)(N+)(=O)(O))OC)C(=O)OC
COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)C(=O)OC)(N+)(=O)(O)
DIMETHYL2(((4METHOXY3NITROPHENYL)CARBONYL)AMINO)BENZENE14DICARBOXYLATE
DIMETHYL2((4METHOXY3NITROBENZOYL)AMINO)BENZENE14DICARBOXYLATE
DIMETHYL2((4METHOXY3NITROBENZOYL)AMINO)TEREPHTHALATE
InChI=1SC18H16N2O8c126157510(914(15)20(24)25)16(21)1913811(17(22)272)4612(13)18(23)283h49H13H3(H1921)
METHYL4(METHOXYCARBONYL)3((4METHOXY3NITROPHENYL)CARBONYLAMINO)BENZOATE
MFCD01216412
STK053849
ZINC000000834220
ZINC00834220
ZINC834220

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Available files

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