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Vitas-M small molecule compound

5,7-dimethoxy-1',3',3'-trimethyl-5',6-dinitro-1',3'-dihydrospiro[chromene-2,2'-indole]

Catalog ID
STL321290
SMILES COc1cc2OC3(C=Cc2c(c1[N+](=O)[O-])OC)N(C)c1c(C3(C)C)cc(cc1)[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 C21H21N3O7 MW 427.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O7/c1-20(2)14-10-12(23(25)26)6-7-15(14)22(3)21(20)9-8-13-16(31-21)11-17(29-4)18(24(27)28)19(13)30-5/h6-11H,1-5H3
InChIKey
NJDDGUXRBZSIHN-UHFFFAOYSA-N
Synonyms
113887-51-7
57dimethoxy133trimethyl56dinitro13dihydrospiro(chromene22indole)
57DIMETHOXY133TRIMETHYL56DINITROSPIRO(CHROMENE22INDOLE)
57dimethoxy133trimethyl56dinitrospiro(chromene22indoline)
CC1(C2=C(C=CC(=C2)(N+)(=O)(O))N(C13C=CC4=C(C(=C(C=C4O3)OC)(N+)(=O)(O))OC)C)C
COc1cc2OC3(C=Cc2c(c1(N+)(=O)(O))OC)N(C)c1c(C3(C)C)cc(cc1)(N+)(=O)(O)
Registry IDs
MFCD00329482
ZINC000008926021
ZINC000008926022

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

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