Vitas-M small molecule compound

N,N'-(3,3'-dimethoxybiphenyl-4,4'-diyl)bis(3-nitrobenzamide)

Catalog ID
STK427922
SMILES COc1cc(ccc1NC(=O)c1cccc(c1)[N+](=O)[O-])c1ccc(c(c1)OC)NC(=O)c1cccc(c1)[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 C28H22N4O8 MW 542.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O8/c1-39-25-15-17(9-11-23(25)29-27(33)19-5-3-7-21(13-19)31(35)36)18-10-12-24(26(16-18)40-2)30-28(34)20-6-4-8-22(14-20)32(37)38/h3-16H,1-2H3,(H,29,33)(H,30,34)
InChIKey
GWTRFUFKRZNRHO-UHFFFAOYSA-N
Synonyms

COC1=C(C=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)(N+)(=O)(O))OC)NC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
COc1cc(ccc1NC(=O)c1cccc(c1)(N+)(=O)(O))c1ccc(c(c1)OC)NC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC28H22N4O8c139251517(91123(25)2927(33)1953721(1319)31(35)36)18101224(26(1618)402)3028(34)2064822(1420)32(37)38h316H12H3(H2933)(H3034)
MFCD00587693
N(2METHOXY4(3METHOXY4((3NITROBENZOYL)AMINO)PHENYL)PHENYL)3NITROBENZAMIDE
N(2METHOXY4(3METHOXY4((3NITROPHENYL)CARBONYLAMINO)PHENYL)PHENYL)(3NITROPHENYL)CARBOXAMIDE
NN(33dimethoxybiphenyl44diyl)bis(3nitrobenzamide)
ZINC000002747196
ZINC2747196

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Available files

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