Vitas-M small molecule compound
[4-(4-chloro-2-nitrophenyl)piperazin-1-yl](3,4,5-trimethoxyphenyl)methanone
Catalog ID
STK360934
SMILES COc1cc(cc(c1OC)OC)C(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])Cl
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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 C20H22ClN3O6 MW 435.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN3O6/c1-28-17-10-13(11-18(29-2)19(17)30-3)20(25)23-8-6-22(7-9-23)15-5-4-14(21)12-16(15)24(26)27/h4-5,10-12H,6-9H2,1-3H3InChIKey
AIJYZFILQIOITP-UHFFFAOYSA-NSynonyms
(4(4CHLORO2NITROPHENYL)PIPERAZIN1YL)(345TRIMETHOXYPHENYL)METHANONE
4(4CHLORO2NITROPHENYL)PIPERAZINYL345TRIMETHOXYPHENYLKETONE
COC1=CC(=CC(=C1OC)OC)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)(N+)(=O)(O)
COc1cc(cc(c1OC)OC)C(=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))Cl
InChI=1SC20H22ClN3O6c128171013(1118(292)19(17)303)20(25)238622(7923)155414(21)1216(15)24(26)27h451012H69H213H3
MFCD02625607
ZINC000008857496
ZINC08857496
ZINC8857496
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