Vitas-M small molecule compound
7-methyl-1-(4-methylphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Catalog ID
STK769543
SMILES Cc1ccc(cc1)Oc1cc(cc2c1C(=O)Nc1c(O2)cc(cc1)C)[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 C21H16N2O5 MW 376.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O5/c1-12-3-6-15(7-4-12)27-18-10-14(23(25)26)11-19-20(18)21(24)22-16-8-5-13(2)9-17(16)28-19/h3-11H,1-2H3,(H,22,24)InChIKey
PGHQEOQDONAMFA-UHFFFAOYSA-NSynonyms
2METHYL7(4METHYLPHENOXY)9NITRO5HBENZO(B)(14)BENZOXAZEPIN6ONE
7METHYL1(4METHYLPHENOXY)3NITRO10HDIBENZO(BF)14OXAZAPERHYDROEPIN11ONE
7methyl1(4methylphenoxy)3nitrodibenzo(bf)(14)oxazepin11(10H)one
CC1=CC=C(C=C1)OC2=CC(=CC3=C2C(=O)NC4=C(O3)C=C(C=C4)C)(N+)(=O)(O)
Cc1ccc(cc1)Oc1cc(cc2c1C(=O)Nc1c(O2)cc(cc1)C)(N+)(=O)(O)
InChI=1SC21H16N2O5c1123615(7412)27181014(23(25)26)111920(18)21(24)22168513(2)917(16)2819h311H12H3(H2224)
MFCD03409294
ZINC000001071839
ZINC01071839
ZINC1071839
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