Vitas-M small molecule compound
dimethyl 2'-amino-5-bromo-6'-(2-methoxy-2-oxoethyl)-1-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate
Catalog ID
STK729820
SMILES COC(=O)CC1=C(C(=O)OC)C2(C(=C(O1)N)C(=O)OC)c1cc(Br)ccc1N(C2=O)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 C20H19BrN2O8 MW 495.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrN2O8/c1-23-11-6-5-9(21)7-10(11)20(19(23)27)14(17(25)29-3)12(8-13(24)28-2)31-16(22)15(20)18(26)30-4/h5-7H,8,22H2,1-4H3InChIKey
UONFXZZTOHWXNI-UHFFFAOYSA-NSynonyms
CN1C2=C(C=C(C=C2)Br)C3(C1=O)C(=C(OC(=C3C(=O)OC)N)CC(=O)OC)C(=O)OC
dimethyl2amino5bromo6(2methoxy2oxoethyl)1methyl2oxo12dihydrospiro(indole34pyran)35dicarboxylate
DIMETHYL2AMINO5BROMO6(2METHOXY2OXOETHYL)1METHYL2OXOSPIRO(INDOLE34PYRAN)35DICARBOXYLATE
InChI=1SC20H19BrN2O8c12311659(21)710(11)20(19(23)27)14(17(25)293)12(813(24)282)3116(22)15(20)18(26)304h57H822H214H3
MFCD06618274
ZINC000009695527
ZINC000009695528
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