Vitas-M small molecule compound

N-[3-(5-methoxy-1,3-benzoxazol-2-yl)phenyl]-2-nitrobenzamide

Catalog ID
STK174404
SMILES COc1ccc2c(c1)nc(o2)c1cccc(c1)NC(=O)c1ccccc1[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 C21H15N3O5 MW 389.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O5/c1-28-15-9-10-19-17(12-15)23-21(29-19)13-5-4-6-14(11-13)22-20(25)16-7-2-3-8-18(16)24(26)27/h2-12H,1H3,(H,22,25)
InChIKey
LTSCIUYNCWFNGK-UHFFFAOYSA-N
Synonyms

COC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4(N+)(=O)(O)
COc1ccc2c(c1)nc(o2)c1cccc(c1)NC(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC21H15N3O5c128159101917(1215)2321(2919)1354614(1113)2220(25)16723818(16)24(26)27h212H1H3(H2225)
MFCD05796869
N(3(5METHOXY13BENZOXAZOL2YL)PHENYL)2NITROBENZAMIDE
ZINC000002861478
ZINC02861478
ZINC2861478

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Available files

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