Vitas-M small molecule compound
ethyl 4-[3-(2,3-dichlorophenyl)-1',3',4,6-tetraoxo-1',3',3a,4,6,6a-hexahydrospiro[furo[3,4-c]pyrrole-1,2'-inden]-5(3H)-yl]benzoate
Catalog ID
STK077670
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1(OC2c2cccc(c2Cl)Cl)C(=O)c2c(C1=O)cccc2
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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 C29H19Cl2NO7 MW 564.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H19Cl2NO7/c1-2-38-28(37)14-10-12-15(13-11-14)32-26(35)20-21(27(32)36)29(24(33)16-6-3-4-7-17(16)25(29)34)39-23(20)18-8-5-9-19(30)22(18)31/h3-13,20-21,23H,2H2,1H3InChIKey
BNEGXOKJAOSICZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)C4(C(=O)C5=CC=CC=C5C4=O)OC3C6=C(C(=CC=C6)Cl)Cl
CCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1(OC2c2cccc(c2Cl)Cl)C(=O)c2c(C1=O)cccc2
ethyl4(1(23dichlorophenyl)1346tetraoxospiro(3a6adihydro1Hfuro(34c)pyrrole32indene)5yl)benzoate
ethyl4(3(23dichlorophenyl)1346tetraoxo133a466ahexahydrospiro(furo(34c)pyrrole12inden)5(3H)yl)benzoate
ethyl4(3(23dichlorophenyl)1346tetraoxo13a3466ahexahydrospiro(furo(34c)pyrrole12inden)5(3H)yl)benzoate
InChI=1SC29H19Cl2NO7c123828(37)14101215(131114)3226(35)2021(27(32)36)29(24(33)16634717(16)25(29)34)3923(20)1885919(30)22(18)31h313202123H2H21H3
MFCD01138112
STK077670
ZINC000004150546
ZINC000239025397
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.