Vitas-M small molecule compound

[4-(2-chloro-4-nitrophenyl)piperazin-1-yl](3-methylfuran-2-yl)methanone

Catalog ID
STK735280
SMILES Clc1cc(ccc1N1CCN(CC1)C(=O)c1occc1C)[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 C16H16ClN3O4 MW 349.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O4/c1-11-4-9-24-15(11)16(21)19-7-5-18(6-8-19)14-3-2-12(20(22)23)10-13(14)17/h2-4,9-10H,5-8H2,1H3
InChIKey
CLCMRBFMJBBJFT-UHFFFAOYSA-N
Synonyms

(4(2chloro4nitrophenyl)piperazin1yl)(3methylfuran2yl)methanone
1(2CHLORO4NITROPHENYL)4((3METHYLFURAN2YL)CARBONYL)PIPERAZINE
CC1=C(OC=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)(N+)(=O)(O))Cl
Clc1cc(ccc1N1CCN(CC1)C(=O)c1occc1C)(N+)(=O)(O)
InChI=1SC16H16ClN3O4c111492415(11)16(21)197518(6819)143212(20(22)23)1013(14)17h24910H58H21H3
MFCD01209884
ZINC000004181679
ZINC04181679
ZINC4181679

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Available files

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