Vitas-M small molecule compound

8-chloro-1-(4-methoxyphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one

Catalog ID
STK768842
SMILES COc1ccc(cc1)Oc1cc(cc2c1C(=O)Nc1c(O2)ccc(c1)Cl)[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 C20H13ClN2O6 MW 412.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClN2O6/c1-27-13-3-5-14(6-4-13)28-17-9-12(23(25)26)10-18-19(17)20(24)22-15-8-11(21)2-7-16(15)29-18/h2-10H,1H3,(H,22,24)
InChIKey
WGCZASGDUNETGQ-UHFFFAOYSA-N
Synonyms

3CHLORO7(4METHOXYPHENOXY)9NITRO5HBENZO(B)(14)BENZOXAZEPIN6ONE
8CHLORO1(4METHOXYPHENOXY)3NITRO10HDIBENZO(BF)14OXAZAPERHYDROEPIN11ONE
8chloro1(4methoxyphenoxy)3nitrodibenzo(bf)(14)oxazepin11(10H)one
COC1=CC=C(C=C1)OC2=CC(=CC3=C2C(=O)NC4=C(O3)C=CC(=C4)Cl)(N+)(=O)(O)
COc1ccc(cc1)Oc1cc(cc2c1C(=O)Nc1c(O2)ccc(c1)Cl)(N+)(=O)(O)
InChI=1SC20H13ClN2O6c127133514(6413)2817912(23(25)26)101819(17)20(24)2215811(21)2716(15)2918h210H1H3(H2224)
MFCD03308534
ZINC000001097646
ZINC01097646
ZINC1097646

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Available files

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