Vitas-M small molecule compound
8-chloro-1-(2-methylphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Catalog ID
STK768742
SMILES Clc1ccc2c(c1)NC(=O)c1c(O2)cc(cc1Oc1ccccc1C)[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/c1-11-4-2-3-5-15(11)27-17-9-13(23(25)26)10-18-19(17)20(24)22-14-8-12(21)6-7-16(14)28-18/h2-10H,1H3,(H,22,24)InChIKey
XTYHZMZALPGGMV-UHFFFAOYSA-NSynonyms
3CHLORO7(2METHYLPHENOXY)9NITRO5HBENZO(B)(14)BENZOXAZEPIN6ONE
8CHLORO1(2METHYLPHENOXY)3NITRO10HDIBENZO(BF)14OXAZAPERHYDROEPIN11ONE
8chloro1(2methylphenoxy)3nitrodibenzo(bf)(14)oxazepin11(10H)one
CC1=CC=CC=C1OC2=CC(=CC3=C2C(=O)NC4=C(O3)C=CC(=C4)Cl)(N+)(=O)(O)
Clc1ccc2c(c1)NC(=O)c1c(O2)cc(cc1Oc1ccccc1C)(N+)(=O)(O)
InChI=1SC20H13ClN2O5c111423515(11)2717913(23(25)26)101819(17)20(24)2214812(21)6716(14)2818h210H1H3(H2224)
MFCD03308048
ZINC000001097640
ZINC01097640
ZINC1097640
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