Vitas-M small molecule compound
1,4-diazepane-1,4-diylbis[(3-methyl-4-nitrophenyl)methanone]
Catalog ID
STK431116
SMILES O=C(c1ccc(c(c1)C)[N+](=O)[O-])N1CCCN(CC1)C(=O)c1ccc(c(c1)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 C21H22N4O6 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O6/c1-14-12-16(4-6-18(14)24(28)29)20(26)22-8-3-9-23(11-10-22)21(27)17-5-7-19(25(30)31)15(2)13-17/h4-7,12-13H,3,8-11H2,1-2H3InChIKey
GVLWLSTXVOVOJW-UHFFFAOYSA-NSynonyms
(4(3METHYL4NITROBENZOYL)14DIAZEPAN1YL)(3METHYL4NITROPHENYL)METHANONE
14diazepane14diylbis((3methyl4nitrophenyl)methanone)
3METHYL4NITROPHENYL4((3METHYL4NITROPHENYL)CARBONYL)(14DIAZAPERHYDROEPINYL)KETONE
CC1=C(C=CC(=C1)C(=O)N2CCCN(CC2)C(=O)C3=CC(=C(C=C3)(N+)(=O)(O))C)(N+)(=O)(O)
InChI=1SC21H22N4O6c1141216(4618(14)24(28)29)20(26)2283923(111022)21(27)175719(25(30)31)15(2)1317h471213H3811H212H3
MFCD03402044
O=C(c1ccc(c(c1)C)(N+)(=O)(O))N1CCCN(CC1)C(=O)c1ccc(c(c1)C)(N+)(=O)(O)
ZINC000002749119
ZINC02749119
ZINC2749119
Check stock
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Check stock on Vitas-MAvailable files
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