Vitas-M small molecule compound
1-(4-bromophenoxy)-10-butyl-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Catalog ID
STK769062
SMILES CCCCN1C(=O)c2c(Oc3ccc(cc3)Br)cc(cc2Oc2c1cccc2)[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 C23H19BrN2O5 MW 483.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19BrN2O5/c1-2-3-12-25-18-6-4-5-7-19(18)31-21-14-16(26(28)29)13-20(22(21)23(25)27)30-17-10-8-15(24)9-11-17/h4-11,13-14H,2-3,12H2,1H3InChIKey
PZESDWYRUWERIA-UHFFFAOYSA-NSynonyms
1(4bromophenoxy)10butyl3nitrodibenzo(bf)(14)oxazepin11(10H)one
7(4BROMOPHENOXY)5BUTYL9NITROBENZO(B)(14)BENZOXAZEPIN6ONE
CCCCN1C(=O)c2c(Oc3ccc(cc3)Br)cc(cc2Oc2c1cccc2)(N+)(=O)(O)
CCCCN1C2=CC=CC=C2OC3=C(C1=O)C(=CC(=C3)(N+)(=O)(O))OC4=CC=C(C=C4)Br
InChI=1SC23H19BrN2O5c123122518645719(18)31211416(26(28)29)1320(22(21)23(25)27)301710815(24)91117h4111314H2312H21H3
MFCD03408393
ZINC000003620511
ZINC03620511
ZINC3620511
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