Vitas-M small molecule compound

5-nitro-2-[3-(trifluoromethyl)phenyl]-1H-isoindole-1,3(2H)-dione

Catalog ID
STK391635
SMILES O=C1c2cc(ccc2C(=O)N1c1cccc(c1)C(F)(F)F)[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 C15H7F3N2O4 MW 336.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H7F3N2O4/c16-15(17,18)8-2-1-3-9(6-8)19-13(21)11-5-4-10(20(23)24)7-12(11)14(19)22/h1-7H
InChIKey
DVDOFFINVKJVSF-UHFFFAOYSA-N
Synonyms

5nitro2(3(trifluoromethyl)phenyl)1Hisoindole13(2H)dione
5NITRO2(3(TRIFLUOROMETHYL)PHENYL)BENZO(C)AZOLINE13DIONE
5NITRO2(3(TRIFLUOROMETHYL)PHENYL)ISOINDOLE13DIONE
5NITRO2(3TRIFLUOROMETHYLPHENYL)ISOINDOLE13DIONE
C1=CC(=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)(N+)(=O)(O))C(F)(F)F
InChI=1SC15H7F3N2O4c1615(1718)82139(68)1913(21)115410(20(23)24)712(11)14(19)22h17H
MFCD00603915
O=C1c2cc(ccc2C(=O)N1c1cccc(c1)C(F)(F)F)(N+)(=O)(O)
ZINC000000362480
ZINC00362480
ZINC362480

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Available files

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