Vitas-M small molecule compound

1-nitro-10-(4-nitrobenzyl)-3-phenoxydibenzo[b,f][1,4]oxazepin-11(10H)-one

Catalog ID
STK769567
SMILES O=C1N(Cc2ccc(cc2)[N+](=O)[O-])c2ccccc2Oc2c1c(cc(c2)Oc1ccccc1)[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 C26H17N3O7 MW 483.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17N3O7/c30-26-25-22(29(33)34)14-20(35-19-6-2-1-3-7-19)15-24(25)36-23-9-5-4-8-21(23)27(26)16-17-10-12-18(13-11-17)28(31)32/h1-15H,16H2
InChIKey
AIYKYLYNDMVYMD-UHFFFAOYSA-N
Synonyms

1NITRO10((4NITROPHENYL)METHYL)3PHENOXYDIBENZO(BF)14OXAZAPERHYDROEPIN11ONE
1nitro10(4nitrobenzyl)3phenoxydibenzo(bf)(14)oxazepin11(10H)one
7NITRO5((4NITROPHENYL)METHYL)9PHENOXYBENZO(B)(14)BENZOXAZEPIN6ONE
C1=CC=C(C=C1)OC2=CC3=C(C(=C2)(N+)(=O)(O))C(=O)N(C4=CC=CC=C4O3)CC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC26H17N3O7c30262522(29(33)34)1420(35196213719)1524(25)3623954821(23)27(26)1617101218(131117)28(31)32h115H16H2
MFCD03409337
O=C1N(Cc2ccc(cc2)(N+)(=O)(O))c2ccccc2Oc2c1c(cc(c2)Oc1ccccc1)(N+)(=O)(O)
ZINC000003622304
ZINC03622304
ZINC3622304

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Available files

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