Vitas-M small molecule compound
[4-(2-chloro-6-nitrophenyl)piperazin-1-yl](2-methoxyphenyl)methanone
Catalog ID
STK255189
SMILES COc1ccccc1C(=O)N1CCN(CC1)c1c(Cl)cccc1[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 C18H18ClN3O4 MW 375.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O4/c1-26-16-8-3-2-5-13(16)18(23)21-11-9-20(10-12-21)17-14(19)6-4-7-15(17)22(24)25/h2-8H,9-12H2,1H3InChIKey
UCCADQDFFBLMGB-UHFFFAOYSA-NSynonyms
(4(2chloro6nitrophenyl)piperazin1yl)(2methoxyphenyl)methanone
COC1=CC=CC=C1C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)(N+)(=O)(O)
COc1ccccc1C(=O)N1CCN(CC1)c1c(Cl)cccc1(N+)(=O)(O)
InChI=1SC18H18ClN3O4c12616832513(16)18(23)2111920(101221)1714(19)64715(17)22(24)25h28H912H21H3
MFCD04218461
ZINC000004998625
ZINC04998625
ZINC4998625
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