Vitas-M small molecule compound
2-[4-(benzyloxy)phenyl]-2-oxoethyl 2-chloro-5-nitrobenzoate
Catalog ID
STK388670
SMILES O=C(c1ccc(cc1)OCc1ccccc1)COC(=O)c1cc(ccc1Cl)[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 C22H16ClNO6 MW 425.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClNO6/c23-20-11-8-17(24(27)28)12-19(20)22(26)30-14-21(25)16-6-9-18(10-7-16)29-13-15-4-2-1-3-5-15/h1-12H,13-14H2InChIKey
YXOZNRQHNPKVCO-UHFFFAOYSA-NSynonyms
355426-12-9(2OXO2(4PHENYLMETHOXYPHENYL)ETHYL)2CHLORO5NITROBENZOATE
2(4(benzyloxy)phenyl)2oxoethyl2chloro5nitrobenzoate
355426129
C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)COC(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl
InChI=1SC22H16ClNO6c232011817(24(27)28)1219(20)22(26)301421(25)166918(10716)2913154213515h112H1314H2
MFCD02314500
O=C(c1ccc(cc1)OCc1ccccc1)COC(=O)c1cc(ccc1Cl)(N+)(=O)(O)
ZINC000008721572
ZINC08721572
ZINC8721572
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