Vitas-M small molecule compound

5-nitro-2-(4-phenoxyphenyl)-1H-isoindole-1,3(2H)-dione

Catalog ID
STK701363
SMILES O=C1c2cc(ccc2C(=O)N1c1ccc(cc1)Oc1ccccc1)[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 C20H12N2O5 MW 360.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12N2O5/c23-19-17-11-8-14(22(25)26)12-18(17)20(24)21(19)13-6-9-16(10-7-13)27-15-4-2-1-3-5-15/h1-12H
InChIKey
QPJBILZCEAUTSD-UHFFFAOYSA-N
Synonyms

5nitro2(4phenoxyphenyl)1Hisoindole13(2H)dione
5NITRO2(4PHENOXYPHENYL)BENZO(C)AZOLINE13DIONE
5NITRO2(4PHENOXYPHENYL)ISOINDOLE13DIONE
C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)(N+)(=O)(O)
InChI=1SC20H12N2O5c23191711814(22(25)26)1218(17)20(24)21(19)136916(10713)27154213515h112H
MFCD00554997
O=C1c2cc(ccc2C(=O)N1c1ccc(cc1)Oc1ccccc1)(N+)(=O)(O)
ZINC000000705203
ZINC00705203
ZINC705203

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Available files

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