Vitas-M small molecule compound
methyl 2-{[(3-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}benzoate
Catalog ID
STL257438
SMILES COC(=O)c1ccccc1NC(=O)C1(C)OC(=O)c2c(C1)cccc2
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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/c1-19(11-12-7-3-4-8-13(12)17(22)25-19)18(23)20-15-10-6-5-9-14(15)16(21)24-2/h3-10H,11H2,1-2H3,(H,20,23)InChIKey
KSUHDLSORFHOHX-UHFFFAOYSA-NSynonyms
708283-88-92((3METHYL1OXOISOCHROMAN3CARBONYL)AMINO)BENZOICACIDMETHYLESTER
708283889
CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NC3=CC=CC=C3C(=O)OC
InChI=1SC19H17NO5c119(1112734813(12)17(22)2519)18(23)20151065914(15)16(21)242h310H11H212H3(H2023)
METHYL2(((3METHYL1OXO34DIHYDRO1HISOCHROMEN3YL)CARBONYL)AMINO)BENZOATE
METHYL2((3METHYL1OXO4HISOCHROMENE3CARBONYL)AMINO)BENZOATE
METHYL2((3METHYL1OXOISOCHROMAN3YL)CARBONYLAMINO)BENZOATE
methyl2(3methyl1oxoisochroman3carboxamido)benzoate
MFCD04144276
ZINC000000490459
ZINC000000490460
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