Vitas-M small molecule compound
3-[4-(3,5-dinitrophenoxy)phenyl]-1-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-one
Catalog ID
STK755970
SMILES COc1ccccc1N1CCN(CC1)C(=O)CCc1ccc(cc1)Oc1cc(cc(c1)[N+](=O)[O-])[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 C26H26N4O7 MW 506.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O7/c1-36-25-5-3-2-4-24(25)27-12-14-28(15-13-27)26(31)11-8-19-6-9-22(10-7-19)37-23-17-20(29(32)33)16-21(18-23)30(34)35/h2-7,9-10,16-18H,8,11-15H2,1H3InChIKey
HUVPAFVOTNKYFX-UHFFFAOYSA-NSynonyms
3(4(35dinitrophenoxy)phenyl)1(4(2methoxyphenyl)piperazin1yl)propan1one
COC1=CC=CC=C1N2CCN(CC2)C(=O)CCC3=CC=C(C=C3)OC4=CC(=CC(=C4)(N+)(=O)(O))(N+)(=O)(O)
COc1ccccc1N1CCN(CC1)C(=O)CCc1ccc(cc1)Oc1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC26H26N4O7c13625532424(25)27121428(151327)26(31)118196922(10719)37231720(29(32)33)1621(1823)30(34)35h279101618H81115H21H3
MFCD01002447
ZINC000004419950
ZINC04419950
ZINC4419950
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