Vitas-M small molecule compound

2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 4-[(4-methylphenyl)amino]-4-oxobutanoate

Catalog ID
STK326561
SMILES O=C(OCC(=O)c1ccc(cc1)Oc1c(Cl)cccc1[N+](=O)[O-])CCC(=O)Nc1ccc(cc1)C

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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 C25H21ClN2O7 MW 496.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O7/c1-16-5-9-18(10-6-16)27-23(30)13-14-24(31)34-15-22(29)17-7-11-19(12-8-17)35-25-20(26)3-2-4-21(25)28(32)33/h2-12H,13-15H2,1H3,(H,27,30)
InChIKey
CUJTYSCTTZJIDR-UHFFFAOYSA-N
Synonyms
432010-34-9
(2(4(2CHLORO6NITROPHENOXY)PHENYL)2OXOETHYL)4(4METHYLANILINO)4OXOBUTANOATE
2(4(2chloro6nitrophenoxy)phenyl)2oxoethyl4((4methylphenyl)amino)4oxobutanoate
432010349
CC1=CC=C(C=C1)NC(=O)CCC(=O)OCC(=O)C2=CC=C(C=C2)OC3=C(C=CC=C3Cl)(N+)(=O)(O)
InChI=1SC25H21ClN2O7c1165918(10616)2723(30)131424(31)341522(29)1771119(12817)352520(26)32421(25)28(32)33h212H1315H21H3(H2730)
MFCD03141923
O=C(OCC(=O)c1ccc(cc1)Oc1c(Cl)cccc1(N+)(=O)(O))CCC(=O)Nc1ccc(cc1)C
ZINC000001848445
ZINC01848445
ZINC1848445

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Available files

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