Vitas-M small molecule compound
dimethyl 2-{[(3,7-dimethyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}benzene-1,4-dicarboxylate
Catalog ID
STL017927
SMILES COC(=O)c1ccc(cc1NC(=O)C1(C)OC(=O)c2c(C1)ccc(c2)C)C(=O)OC
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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 C22H21NO7 MW 411.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO7/c1-12-5-6-14-11-22(2,30-20(26)16(14)9-12)21(27)23-17-10-13(18(24)28-3)7-8-15(17)19(25)29-4/h5-10H,11H2,1-4H3,(H,23,27)InChIKey
WPFLSXKNVBNAQF-UHFFFAOYSA-NSynonyms
900134-31-8900134318
CC1=CC2=C(CC(OC2=O)(C)C(=O)NC3=C(C=CC(=C3)C(=O)OC)C(=O)OC)C=C1
dimethyl2(((37dimethyl1oxo34dihydro1Hisochromen3yl)carbonyl)amino)benzene14dicarboxylate
dimethyl2((37dimethyl1oxo4Hisochromene3carbonyl)amino)benzene14dicarboxylate
DIMETHYL2(37DIMETHYL1OXOISOCHROMAN3CARBOXAMIDO)TEREPHTHALATE
InChI=1SC22H21NO7c11256141122(23020(26)16(14)912)21(27)23171013(18(24)283)7815(17)19(25)294h510H11H214H3(H2327)
METHYL3((37DIMETHYL1OXOISOCHROMAN3YL)CARBONYLAMINO)4(METHOXYCARBONYL)BENZOATE
MFCD07808254
ZINC000010435225
ZINC000010435229
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