Vitas-M small molecule compound

2-oxo-2-phenylethyl 2-[3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)phenyl]quinoline-4-carboxylate

Catalog ID
STK286894
SMILES O=C1N(c2cccc(c2)c2nc3ccccc3c(c2)C(=O)OCC(=O)c2ccccc2)C(=O)C2C1C1CCC2C1

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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 C33H26N2O5 MW 530.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26N2O5/c36-28(19-7-2-1-3-8-19)18-40-33(39)25-17-27(34-26-12-5-4-11-24(25)26)20-9-6-10-23(16-20)35-31(37)29-21-13-14-22(15-21)30(29)32(35)38/h1-12,16-17,21-22,29-30H,13-15,18H2
InChIKey
XJZBFRGUXOROOP-UHFFFAOYSA-N
Synonyms

2oxo2phenylethyl2(3(13dioxooctahydro2H47methanoisoindol2yl)phenyl)quinoline4carboxylate
C1CC2CC1C3C2C(=O)N(C3=O)C4=CC=CC(=C4)C5=NC6=CC=CC=C6C(=C5)C(=O)OCC(=O)C7=CC=CC=C7
InChI=1SC33H26N2O5c3628(197213819)184033(39)251727(342612541124(25)26)20961023(1620)3531(37)2921131422(1521)30(29)32(35)38h112161721222930H131518H2
MFCD03648883
ZINC000102517459
ZINC000239433232

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Available files

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