Vitas-M small molecule compound
1-(4-chlorophenoxy)-7-methyl-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Catalog ID
STK768843
SMILES Clc1ccc(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 C20H13ClN2O5 MW 396.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClN2O5/c1-11-2-7-15-16(8-11)28-18-10-13(23(25)26)9-17(19(18)20(24)22-15)27-14-5-3-12(21)4-6-14/h2-10H,1H3,(H,22,24)InChIKey
ZQOIAUYEJQVMRH-UHFFFAOYSA-NSynonyms
1(4CHLOROPHENOXY)7METHYL3NITRO10HDIBENZO(BF)14OXAZAPERHYDROEPIN11ONE
1(4chlorophenoxy)7methyl3nitrodibenzo(bf)(14)oxazepin11(10H)one
7(4CHLOROPHENOXY)2METHYL9NITRO5HBENZO(B)(14)BENZOXAZEPIN6ONE
CC1=CC2=C(C=C1)NC(=O)C3=C(O2)C=C(C=C3OC4=CC=C(C=C4)Cl)(N+)(=O)(O)
Clc1ccc(cc1)Oc1cc(cc2c1C(=O)Nc1c(O2)cc(cc1)C)(N+)(=O)(O)
InChI=1SC20H13ClN2O5c111271516(811)28181013(23(25)26)917(19(18)20(24)2215)27145312(21)4614h210H1H3(H2224)
MFCD03308532
ZINC000001097647
ZINC01097647
ZINC1097647
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