Vitas-M small molecule compound
1-(4-methoxyphenoxy)-3-nitrodibenzo[b,f]oxepine
Catalog ID
STK769110
SMILES COc1ccc(cc1)Oc1cc(cc2c1C=Cc1c(O2)cccc1)[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 C21H15NO5 MW 361.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15NO5/c1-25-16-7-9-17(10-8-16)26-20-12-15(22(23)24)13-21-18(20)11-6-14-4-2-3-5-19(14)27-21/h2-13H,1H3InChIKey
URKVIGMSKGSKOJ-UHFFFAOYSA-NSynonyms
1(4METHOXYPHENOXY)3NITRODIBENZO(BF)OXEPIN
1(4methoxyphenoxy)3nitrodibenzo(bf)oxepine
4(4METHOXYPHENOXY)2NITROBENZO(B)(1)BENZOXEPINE
COC1=CC=C(C=C1)OC2=CC(=CC3=C2C=CC4=CC=CC=C4O3)(N+)(=O)(O)
COc1ccc(cc1)Oc1cc(cc2c1C=Cc1c(O2)cccc1)(N+)(=O)(O)
InChI=1SC21H15NO5c125167917(10816)26201215(22(23)24)132118(20)11614423519(14)2721h213H1H3
MFCD03408457
ZINC000002601168
ZINC02601168
ZINC2601168
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