Vitas-M small molecule compound

1',2,2-trimethyl-6'-nitro-2'-phenyl-1',4'-dihydro-2'H-spiro[1,3-dioxane-5,3'-quinoline]-4,6-dione

Catalog ID
STK724690
SMILES O=C1OC(C)(C)OC(=O)C21Cc1cc(ccc1N(C2c1ccccc1)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 C21H20N2O6 MW 396.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O6/c1-20(2)28-18(24)21(19(25)29-20)12-14-11-15(23(26)27)9-10-16(14)22(3)17(21)13-7-5-4-6-8-13/h4-11,17H,12H2,1-3H3
InChIKey
JYTZUGJSRZWHSI-UHFFFAOYSA-N
Synonyms
879568-25-9
122trimethyl6nitro2phenyl14dihydro2Hspiro(13dioxane53quinoline)46dione
122trimethyl6nitro2phenyl24dihydro1Hspiro((13)dioxane53quinoline)46dione
122trimethyl6nitro2phenylspiro(13dioxane5324dihydroquinoline)46dione
879568259
CC1(OC(=O)C2(CC3=C(C=CC(=C3)(N+)(=O)(O))N(C2C4=CC=CC=C4)C)C(=O)O1)C
InChI=1SC21H20N2O6c120(2)2818(24)21(19(25)2920)12141115(23(26)27)91016(14)22(3)17(21)137546813h41117H12H213H3
MFCD07639578
O=C1OC(C)(C)OC(=O)C21Cc1cc(ccc1N(C2c1ccccc1)C)(N+)(=O)(O)
ZINC000005426883
ZINC000005426887

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Available files

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