Vitas-M small molecule compound

2-(2-methoxy-4-nitrophenyl)-4-(phenylcarbonyl)hexahydropyrrolo[3,4-a]pyrrolizine-1,3(2H,4H)-dione

Catalog ID
STK588500
SMILES COc1cc(ccc1N1C(=O)C2C(C1=O)C1N(C2C(=O)c2ccccc2)CCC1)[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 C23H21N3O6 MW 435.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O6/c1-32-17-12-14(26(30)31)9-10-15(17)25-22(28)18-16-8-5-11-24(16)20(19(18)23(25)29)21(27)13-6-3-2-4-7-13/h2-4,6-7,9-10,12,16,18-20H,5,8,11H2,1H3
InChIKey
DTRCFYFVHKQYOT-UHFFFAOYSA-N
Synonyms
1024334-99-3
1024334993
2(2methoxy4nitrophenyl)4(phenylcarbonyl)hexahydropyrrolo(34a)pyrrolizine13(2H4H)dione
4benzoyl2(2methoxy4nitrophenyl)46788a8bhexahydro3aHpyrrolo(34a)pyrrolizine13dione
4benzoyl2(2methoxy4nitrophenyl)hexahydropyrrolo(34a)pyrrolizine13(2H8bH)dione
COC1=C(C=CC(=C1)(N+)(=O)(O))N2C(=O)C3C4CCCN4C(C3C2=O)C(=O)C5=CC=CC=C5
COc1cc(ccc1N1C(=O)C2C(C1=O)C1N(C2C(=O)c2ccccc2)CCC1)(N+)(=O)(O)
InChI=1SC23H21N3O6c132171214(26(30)31)91015(17)2522(28)1816851124(16)20(19(18)23(25)29)21(27)136324713h246791012161820H5811H21H3
MFCD06781490
ZINC000217595027
ZINC000245325274

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Available files

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