Vitas-M small molecule compound

2-(4-methoxyphenyl)-2-oxoethyl 4-({5-[2-(3-nitrophenyl)-2-oxoethoxy]-5-oxopentanoyl}amino)benzoate

Catalog ID
STK286597
SMILES COc1ccc(cc1)C(=O)COC(=O)c1ccc(cc1)NC(=O)CCCC(=O)OCC(=O)c1cccc(c1)[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 C29H26N2O10 MW 562.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O10/c1-39-24-14-10-19(11-15-24)25(32)18-41-29(36)20-8-12-22(13-9-20)30-27(34)6-3-7-28(35)40-17-26(33)21-4-2-5-23(16-21)31(37)38/h2,4-5,8-16H,3,6-7,17-18H2,1H3,(H,30,34)
InChIKey
CGMVAYZDHPJXMT-UHFFFAOYSA-N
Synonyms

(2(4METHOXYPHENYL)2OXOETHYL)4((5(2(3NITROPHENYL)2OXOETHOXY)5OXOPENTANOYL)AMINO)BENZOATE
2(4methoxyphenyl)2oxoethyl4((5(2(3nitrophenyl)2oxoethoxy)5oxopentanoyl)amino)benzoate
COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)NC(=O)CCCC(=O)OCC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
COc1ccc(cc1)C(=O)COC(=O)c1ccc(cc1)NC(=O)CCCC(=O)OCC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC29H26N2O10c13924141019(111524)25(32)184129(36)2081222(13920)3027(34)63728(35)401726(33)2142523(1621)31(37)38h245816H3671718H21H3(H3034)
MFCD03756830
ZINC000097948303
ZINC97948303

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Available files

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