Vitas-M small molecule compound

3-(4-hydroxyphenyl)-2-(3-nitrophenyl)-5-(4-nitrophenyl)dihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione

Catalog ID
STK567355
SMILES Oc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])c1cccc(c1)[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 C23H16N4O8 MW 476.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N4O8/c28-18-10-4-13(5-11-18)20-19-21(35-25(20)16-2-1-3-17(12-16)27(33)34)23(30)24(22(19)29)14-6-8-15(9-7-14)26(31)32/h1-12,19-21,28H
InChIKey
HTIGCRRTALNJER-UHFFFAOYSA-N
Synonyms
1024083-31-5
1024083315
3(4HYDROXYPHENYL)2(3NITROPHENYL)5(4NITROPHENYL)3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
3(4hydroxyphenyl)2(3nitrophenyl)5(4nitrophenyl)dihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
3(4hydroxyphenyl)2(3nitrophenyl)5(4nitrophenyl)dihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
C1=CC(=CC(=C1)(N+)(=O)(O))N2C(C3C(O2)C(=O)N(C3=O)C4=CC=C(C=C4)(N+)(=O)(O))C5=CC=C(C=C5)O
InChI=1SC23H16N4O8c281810413(51118)201921(3525(20)1621317(1216)27(33)34)23(30)24(22(19)29)146815(9714)26(31)32h112192128H
MFCD04175256
Oc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)(N+)(=O)(O))c1cccc(c1)(N+)(=O)(O)
ZINC000013770291
ZINC000137836341

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Available files

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