Vitas-M small molecule compound
4-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-2-propyl-1,4-benzoxazepine-3,5(2H,4H)-dione
Catalog ID
STK615563
SMILES CCCC1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1ccc(c(c1)[N+](=O)[O-])OC
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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 C21H20N2O7 MW 412.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O7/c1-3-6-19-21(26)22(20(25)14-7-4-5-8-17(14)30-19)12-16(24)13-9-10-18(29-2)15(11-13)23(27)28/h4-5,7-11,19H,3,6,12H2,1-2H3InChIKey
KBDAAPOHDXDAGM-UHFFFAOYSA-NSynonyms
895841-48-24(2(4methoxy3nitrophenyl)2oxoethyl)2propyl14benzoxazepine35(2H4H)dione
4(2(4methoxy3nitrophenyl)2oxoethyl)2propyl14benzoxazepine35dione
4(2(4METHOXY3NITROPHENYL)2OXOETHYL)2PROPYL2HBENZO(F)14OXAZAPERHYDROEPINE35DIONE
4(2(4methoxy3nitrophenyl)2oxoethyl)2propylbenzo(f)(14)oxazepine35(2H4H)dione
895841482
CCCC1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=CC(=C(C=C3)OC)(N+)(=O)(O)
CCCC1Oc2ccccc2C(=O)N(C1=O)CC(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC21H20N2O7c1361921(26)22(20(25)14745817(14)3019)1216(24)1391018(292)15(1113)23(27)28h4571119H3612H212H3
MFCD08285737
ZINC000006662522
ZINC000006662523
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