Vitas-M small molecule compound
4-{[(3,7-dimethyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}benzoic acid
Catalog ID
STL016516
SMILES Cc1ccc2c(c1)C(=O)OC(C2)(C)C(=O)Nc1ccc(cc1)C(=O)O
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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 C19H17NO5 MW 339.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO5/c1-11-3-4-13-10-19(2,25-17(23)15(13)9-11)18(24)20-14-7-5-12(6-8-14)16(21)22/h3-9H,10H2,1-2H3,(H,20,24)(H,21,22)InChIKey
DETJWDCEVYCTRA-UHFFFAOYSA-NSynonyms
900134-25-04(((37dimethyl1oxo34dihydro1Hisochromen3yl)carbonyl)amino)benzoicacid
4((37dimethyl1oxo4Hisochromene3carbonyl)amino)benzoicacid
4((37DIMETHYL1OXOISOCHROMAN3YL)CARBONYLAMINO)BENZOICACID
4(37DIMETHYL1OXOISOCHROMAN3CARBOXAMIDO)BENZOICACID
900134250
CC1=CC2=C(CC(OC2=O)(C)C(=O)NC3=CC=C(C=C3)C(=O)O)C=C1
InChI=1SC19H17NO5c11134131019(22517(23)15(13)911)18(24)20147512(6814)16(21)22h39H10H212H3(H2024)(H2122)
MFCD07808251
ZINC000010435214
ZINC000010435216
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