Vitas-M small molecule compound

1-oxo-N-(2,4,6-trimethylphenyl)-3,4-dihydro-1H-isochromene-3-carboxamide

Catalog ID
STK864777
SMILES O=C(C1OC(=O)c2c(C1)cccc2)Nc1c(C)cc(cc1C)C

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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 C19H19NO3 MW 309.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO3/c1-11-8-12(2)17(13(3)9-11)20-18(21)16-10-14-6-4-5-7-15(14)19(22)23-16/h4-9,16H,10H2,1-3H3,(H,20,21)
InChIKey
ZBSCZXCLDVDIPC-UHFFFAOYSA-N
Synonyms
627889-90-1
(1OXOISOCHROMAN3YL)N(246TRIMETHYLPHENYL)CARBOXAMIDE
1OXOISOCHROMAN3CARBOXYLICACID(246TRIMETHYLPHENYL)AMIDE
1oxoN(246trimethylphenyl)34dihydro1Hisochromene3carboxamide
1OXON(246TRIMETHYLPHENYL)34DIHYDROISOCHROMENE3CARBOXAMIDE
627889901
CC1=CC(=C(C(=C1)C)NC(=O)C2CC3=CC=CC=C3C(=O)O2)C
InChI=1SC19H19NO3c111812(2)17(13(3)911)2018(21)161014645715(14)19(22)2316h4916H10H213H3(H2021)
MFCD03828510
Nmesityl1oxoisochroman3carboxamide
ZINC000000205513
ZINC000000205514

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.