Vitas-M small molecule compound

2-(3,4-dimethylphenyl)-2-oxoethyl acenaphtho[1,2-b]quinoxaline-9-carboxylate

Catalog ID
STL354465
SMILES O=C(c1ccc2c(c1)nc1c(n2)c2c3c1cccc3ccc2)OCC(=O)c1ccc(c(c1)C)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 C29H20N2O3 MW 444.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20N2O3/c1-16-9-10-19(13-17(16)2)25(32)15-34-29(33)20-11-12-23-24(14-20)31-28-22-8-4-6-18-5-3-7-21(26(18)22)27(28)30-23/h3-14H,15H2,1-2H3
InChIKey
LGMHUOBOKWTIEV-UHFFFAOYSA-N
Synonyms
381206-14-0
(2(34DIMETHYLPHENYL)2OXOETHYL)ACENAPHTHYLENO(12B)QUINOXALINE9CARBOXYLATE
2(34dimethylphenyl)2oxoethylacenaphtho(12b)quinoxaline9carboxylate
381206140
CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)N=C4C5=CC=CC6=C5C(=CC=C6)C4=N3)C
InChI=1SC29H20N2O3c11691019(1317(16)2)25(32)153429(33)2011122324(1420)3128228461853721(26(18)22)27(28)3023h314H15H212H3
MFCD01885684
ZINC000002078776
ZINC02078776
ZINC2078776

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Available files

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