Vitas-M small molecule compound

(4-methoxy-3-nitrophenyl)[4-(4-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STK093915
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)N1CCN(CC1)c1ccc(cc1)[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 C18H18N4O6 MW 386.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O6/c1-28-17-7-2-13(12-16(17)22(26)27)18(23)20-10-8-19(9-11-20)14-3-5-15(6-4-14)21(24)25/h2-7,12H,8-11H2,1H3
InChIKey
NIEDMOBGHHCGNQ-UHFFFAOYSA-N
Synonyms

(4METHOXY3NITROPHENYL)(4(4NITROPHENYL)PIPERAZIN1YL)METHANONE
4METHOXY3NITROPHENYL4(4NITROPHENYL)PIPERAZINYLKETONE
COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H18N4O6c128177213(1216(17)22(26)27)18(23)2010819(91120)143515(6414)21(24)25h2712H811H21H3
MFCD01216522
STK093915
ZINC000004663576
ZINC04663576
ZINC4663576

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.