Vitas-M small molecule compound
methyl 4,5-dimethoxy-2-{[(6-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}benzoate
Catalog ID
STK572154
SMILES COC(=O)c1cc(OC)c(cc1NC(=O)C1OC(=O)c2c(C1)cc(cc2)C)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 C21H21NO7 MW 399.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO7/c1-11-5-6-13-12(7-11)8-18(29-21(13)25)19(23)22-15-10-17(27-3)16(26-2)9-14(15)20(24)28-4/h5-7,9-10,18H,8H2,1-4H3,(H,22,23)InChIKey
CHDXIYQMSVTEGS-UHFFFAOYSA-NSynonyms
874466-96-3874466963
CC1=CC2=C(C=C1)C(=O)OC(C2)C(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC
InChI=1SC21H21NO7c111561312(711)818(2921(13)25)19(23)22151017(273)16(262)914(15)20(24)284h5791018H8H214H3(H2223)
methyl45dimethoxy2(((6methyl1oxo34dihydro1Hisochromen3yl)carbonyl)amino)benzoate
METHYL45DIMETHOXY2((6METHYL1OXO34DIHYDROISOCHROMENE3CARBONYL)AMINO)BENZOATE
METHYL45DIMETHOXY2((6METHYL1OXOISOCHROMAN3YL)CARBONYLAMINO)BENZOATE
methyl45dimethoxy2(6methyl1oxoisochroman3carboxamido)benzoate
MFCD06777642
ZINC000005270979
ZINC000005270985
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