Vitas-M small molecule compound
(4aR,8aS)-1,4-bis[(4-chlorobenzyl)oxy]octahydroquinoxaline-2,3-dione
Catalog ID
STK534804
SMILES O=C1N(OCc2ccc(cc2)Cl)[C@@H]2CCCC[C@@H]2N(C1=O)OCc1ccc(cc1)Cl
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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 C22H22Cl2N2O4 MW 449.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22Cl2N2O4/c23-17-9-5-15(6-10-17)13-29-25-19-3-1-2-4-20(19)26(22(28)21(25)27)30-14-16-7-11-18(24)12-8-16/h5-12,19-20H,1-4,13-14H2/t19-,20+InChIKey
HLDVEGQHXFBFIU-BGYRXZFFSA-NSynonyms
(4aR8aS)14bis((4chlorobenzyl)oxy)octahydroquinoxaline23dione
(4aR8aS)14bis((4chlorophenyl)methoxy)4a56788ahexahydroquinoxaline23dione
C1CCC2C(C1)N(C(=O)C(=O)N2OCC3=CC=C(C=C3)Cl)OCC4=CC=C(C=C4)Cl
InChI=1SC22H22Cl2N2O4c23179515(61017)13292519312420(19)26(22(28)21(25)27)30141671118(24)12816h5121920H141314H2t1920+
MFCD02985363
O=C1N(OCc2ccc(cc2)Cl)(C@@H)2CCCC(C@@H)2N(C1=O)OCc1ccc(cc1)Cl
ZINC000016034704
ZINC16034704
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