Vitas-M small molecule compound

N-(4-methoxybenzyl)-3-methyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxamide

Catalog ID
STL019456
SMILES COc1ccc(cc1)CNC(=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 C19H19NO4 MW 325.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO4/c1-19(11-14-5-3-4-6-16(14)17(21)24-19)18(22)20-12-13-7-9-15(23-2)10-8-13/h3-10H,11-12H2,1-2H3,(H,20,22)
InChIKey
NJCXPGYIJZLFSU-UHFFFAOYSA-N
Synonyms

CC1(CC2=CC=CC=C2C(=O)O1)C(=O)NCC3=CC=C(C=C3)OC
InChI=1SC19H19NO4c119(1114534616(14)17(21)2419)18(22)2012137915(232)10813h310H1112H212H3(H2022)
MFCD06414047
N((4METHOXYPHENYL)METHYL)(3METHYL1OXOISOCHROMAN3YL)CARBOXAMIDE
N((4METHOXYPHENYL)METHYL)3METHYL1OXO4HISOCHROMENE3CARBOXAMIDE
N(4methoxybenzyl)3methyl1oxo34dihydro1Hisochromene3carboxamide
ZINC000004867995
ZINC000004867997

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Available files

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