Vitas-M small molecule compound
7,7-dimethyl-4-(4-nitrophenyl)-4,6,7,8-tetrahydro-2H-chromene-2,5(3H)-dione
Catalog ID
STK684945
SMILES O=C1OC2=C(C(C1)c1ccc(cc1)[N+](=O)[O-])C(=O)CC(C2)(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 C17H17NO5 MW 315.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO5/c1-17(2)8-13(19)16-12(7-15(20)23-14(16)9-17)10-3-5-11(6-4-10)18(21)22/h3-6,12H,7-9H2,1-2H3InChIKey
LISDJFGTPKQELX-UHFFFAOYSA-NSynonyms
4(4NITROPHENYL)77DIMETHYL78DIHYDRO3H1BENZOPYRAN25(4H6H)DIONE
77dimethyl4(4nitrophenyl)3468tetrahydrochromene25dione
77dimethyl4(4nitrophenyl)4678tetrahydro2Hchromene25(3H)dione
CC1(CC2=C(C(CC(=O)O2)C3=CC=C(C=C3)(N+)(=O)(O))C(=O)C1)C
InChI=1SC17H17NO5c117(2)813(19)1612(715(20)2314(16)917)103511(6410)18(21)22h3612H79H212H3
MFCD05856627
O=C1OC2=C(C(C1)c1ccc(cc1)(N+)(=O)(O))C(=O)CC(C2)(C)C
ZINC000001427430
ZINC000001427431
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