Vitas-M small molecule compound

2-({(E)-[4-(2,4-dinitrophenoxy)phenyl]methylidene}amino)-1H-isoindole-1,3(2H)-dione

Catalog ID
STK198440
SMILES O=C1N(/N=C/c2ccc(cc2)Oc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])C(=O)c2c1cccc2

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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 C21H12N4O7 MW 432.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12N4O7/c26-20-16-3-1-2-4-17(16)21(27)23(20)22-12-13-5-8-15(9-6-13)32-19-10-7-14(24(28)29)11-18(19)25(30)31/h1-12H/b22-12+
InChIKey
BAJTUSTUPXQOOV-WSDLNYQXSA-N
Synonyms

2(((E)(4(24DINITROPHENOXY)PHENYL)METHYLIDENE)AMINO)1HISOINDOLE13(2H)DIONE
2((E)(4(24dinitrophenoxy)phenyl)methylideneamino)isoindole13dione
C1=CC=C2C(=C1)C(=O)N(C2=O)N=CC3=CC=C(C=C3)OC4=C(C=C(C=C4)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC21H12N4O7c262016312417(16)21(27)23(20)2212135815(9613)321910714(24(28)29)1118(19)25(30)31h112Hb2212+
MFCD01532823
O=C1N(N=Cc2ccc(cc2)Oc2ccc(cc2(N+)(=O)(O))(N+)(=O)(O))C(=O)c2c1cccc2
ZINC000009311146
ZINC96860875

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Available files

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