Vitas-M small molecule compound

2-[4-(4-chloro-2-nitrophenoxy)phenyl]-2-oxoethyl 4,6-dimethyl-2-oxo-2H-pyran-5-carboxylate

Catalog ID
STK388768
SMILES Clc1ccc(c(c1)[N+](=O)[O-])Oc1ccc(cc1)C(=O)COC(=O)c1c(C)cc(=O)oc1C

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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 C22H16ClNO8 MW 457.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClNO8/c1-12-9-20(26)31-13(2)21(12)22(27)30-11-18(25)14-3-6-16(7-4-14)32-19-8-5-15(23)10-17(19)24(28)29/h3-10H,11H2,1-2H3
InChIKey
SNARXHMCQLEWIM-UHFFFAOYSA-N
Synonyms
355426-32-3
(2(4(4CHLORO2NITROPHENOXY)PHENYL)2OXOETHYL)24DIMETHYL6OXOPYRAN3CARBOXYLATE
2(4(4chloro2nitrophenoxy)phenyl)2oxoethyl46dimethyl2oxo2Hpyran5carboxylate
355426323
CC1=CC(=O)OC(=C1C(=O)OCC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)Cl)(N+)(=O)(O))C
Clc1ccc(c(c1)(N+)(=O)(O))Oc1ccc(cc1)C(=O)COC(=O)c1c(C)cc(=O)oc1C
InChI=1SC22H16ClNO8c112920(26)3113(2)21(12)22(27)301118(25)143616(7414)32198515(23)1017(19)24(28)29h310H11H212H3
MFCD02914542
ZINC000001099241
ZINC01099241
ZINC1099241

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Available files

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