Vitas-M small molecule compound
2-chloro-3-[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]naphthalene-1,4-dione
Catalog ID
STK158084
SMILES O=C1C(=C(N2CCN(CC2)c2c(Cl)cccc2[N+](=O)[O-])C(=O)c2c1cccc2)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 C20H15Cl2N3O4 MW 432.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15Cl2N3O4/c21-14-6-3-7-15(25(28)29)17(14)23-8-10-24(11-9-23)18-16(22)19(26)12-4-1-2-5-13(12)20(18)27/h1-7H,8-11H2InChIKey
GNOLONAQXJLMPA-UHFFFAOYSA-NSynonyms
591765-56-92CHLORO3(4(2CHLORO6NITROPHENYL)PIPERAZIN1YL)NAPHTHALENE14DIONE
591765569
C1CN(CCN1C2=C(C=CC=C2Cl)(N+)(=O)(O))C3=C(C(=O)C4=CC=CC=C4C3=O)Cl
InChI=1SC20H15Cl2N3O4c211463715(25(28)29)17(14)2381024(11923)1816(22)19(26)12412513(12)20(18)27h17H811H2
MFCD03691296
O=C1C(=C(N2CCN(CC2)c2c(Cl)cccc2(N+)(=O)(O))C(=O)c2c1cccc2)Cl
ZINC000009007672
ZINC09007672
ZINC9007672
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