Vitas-M small molecule compound

butyl (9Z)-9-(2-carbamoylhydrazinylidene)-2,7-dinitro-9H-fluorene-4-carboxylate

Catalog ID
STK726886
SMILES CCCCOC(=O)c1cc(cc2c1c1ccc(cc1/C/2=N/NC(=O)N)[N+](=O)[O-])[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 C19H17N5O7 MW 427.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O7/c1-2-3-6-31-18(25)15-9-11(24(29)30)8-14-16(15)12-5-4-10(23(27)28)7-13(12)17(14)21-22-19(20)26/h4-5,7-9H,2-3,6H2,1H3,(H3,20,22,26)/b21-17-
InChIKey
DMOCFVXVUCEVFL-FXBPSFAMSA-N
Synonyms

(E)butyl9(2carbamoylhydrazono)27dinitro9Hfluorene4carboxylate
butyl(9Z)9(2carbamoylhydrazinylidene)27dinitro9Hfluorene4carboxylate
BUTYL(9Z)9(CARBAMOYLHYDRAZINYLIDENE)27DINITROFLUORENE4CARBOXYLATE
CCCCOC(=O)C1=C2C3=C(C=C(C=C3)(N+)(=O)(O))C(=NNC(=O)N)C2=CC(=C1)(N+)(=O)(O)
CCCCOC(=O)c1cc(cc2c1c1ccc(cc1C2=NNC(=O)N)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC19H17N5O7c12363118(25)15911(24(29)30)81416(15)125410(23(27)28)713(12)17(14)212219(20)26h4579H236H21H3(H3202226)b2117
MFCD01795189
ZINC000033361293
ZINC04506166
ZINC4506166

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Available files

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