Vitas-M small molecule compound

methyl 3-({[4-(4-nitrophenoxy)phenyl]carbonyl}amino)benzoate

Catalog ID
STK021911
SMILES COC(=O)c1cccc(c1)NC(=O)c1ccc(cc1)Oc1ccc(cc1)[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 C21H16N2O6 MW 392.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O6/c1-28-21(25)15-3-2-4-16(13-15)22-20(24)14-5-9-18(10-6-14)29-19-11-7-17(8-12-19)23(26)27/h2-13H,1H3,(H,22,24)
InChIKey
NMRFJPCEOWQHHS-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)(N+)(=O)(O)
COC(=O)c1cccc(c1)NC(=O)c1ccc(cc1)Oc1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H16N2O6c12821(25)1532416(1315)2220(24)145918(10614)291911717(81219)23(26)27h213H1H3(H2224)
METHYL3(((4(4NITROPHENOXY)PHENYL)CARBONYL)AMINO)BENZOATE
METHYL3((4(4NITROPHENOXY)BENZOYL)AMINO)BENZOATE
MFCD01137625
STK021911
ZINC000001207467
ZINC01207467
ZINC1207467

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Available files

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