Vitas-M small molecule compound
4',4'-dimethyl-3-nitro-6a,7,8,9,10,11-hexahydro-2'H,5H,6'H-spiro[azepino[1,2-a]quinoline-6,1'-cyclohexane]-2',6'-dione
Catalog ID
STK607314
SMILES [O-][N+](=O)c1ccc2c(c1)CC1(C3N2CCCCC3)C(=O)CC(CC1=O)(C)C
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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 C21H26N2O4 MW 370.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O4/c1-20(2)12-18(24)21(19(25)13-20)11-14-10-15(23(26)27)7-8-16(14)22-9-5-3-4-6-17(21)22/h7-8,10,17H,3-6,9,11-13H2,1-2H3InChIKey
PYJKVRGROYPNOI-UHFFFAOYSA-NSynonyms
919725-35-2(O)(N+)(=O)c1ccc2c(c1)CC1(C3N2CCCCC3)C(=O)CC(CC1=O)(C)C
44dimethyl3nitro6a7891011hexahydro2H5H6Hspiro(azepino(12a)quinoline61cyclohexane)26dione
44dimethyl3nitro6a7891011hexahydro5Hspiro(azepino(12a)quinoline61cyclohexane)26dione
55dimethyl3nitrospiro(6a7891011hexahydro5Hazepino(12a)quinoline62cyclohexane)13dione
919725352
CC1(CC(=O)C2(CC3=C(C=CC(=C3)(N+)(=O)(O))N4C2CCCCC4)C(=O)C1)C
InChI=1SC21H26N2O4c120(2)1218(24)21(19(25)1320)11141015(23(26)27)7816(14)229534617(21)22h781017H3691113H212H3
MFCD08745010
ZINC000009061078
ZINC000009061079
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