Vitas-M small molecule compound
3-{[(3-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}benzoic acid
Catalog ID
STL023235
SMILES O=C(C1(C)OC(=O)c2c(C1)cccc2)Nc1cccc(c1)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 C18H15NO5 MW 325.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO5/c1-18(10-12-5-2-3-8-14(12)16(22)24-18)17(23)19-13-7-4-6-11(9-13)15(20)21/h2-9H,10H2,1H3,(H,19,23)(H,20,21)InChIKey
ZOQVIHLVZBVWNR-UHFFFAOYSA-NSynonyms
924765-02-63(((3methyl1oxo34dihydro1Hisochromen3yl)carbonyl)amino)benzoicacid
3((3methyl1oxo4Hisochromene3carbonyl)amino)benzoicacid
3((3METHYL1OXOISOCHROMAN3YL)CARBONYLAMINO)BENZOICACID
3(3METHYL1OXOISOCHROMAN3CARBOXAMIDO)BENZOICACID
924765026
CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=CC=CC(=C3)C(=O)O
InChI=1SC18H15NO5c118(1012523814(12)16(22)2418)17(23)191374611(913)15(20)21h29H10H21H3(H1923)(H2021)
MFCD08742765
ZINC000008764229
ZINC000008764230
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