Vitas-M small molecule compound

N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4-dihydro-1H-isochromene-1-carboxamide

Catalog ID
STK780348
SMILES COc1cc(CCNC(=O)C2OCCc3c2cccc3)ccc1OC

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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 C20H23NO4 MW 341.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO4/c1-23-17-8-7-14(13-18(17)24-2)9-11-21-20(22)19-16-6-4-3-5-15(16)10-12-25-19/h3-8,13,19H,9-12H2,1-2H3,(H,21,22)
InChIKey
UNAPRPDBOFYNGL-UHFFFAOYSA-N
Synonyms

1H2BENZOPYRAN1CARBOXAMIDEN(2(34DIMETHOXYPHENYL)ETHYL)34DIHYDRO
COC1=C(C=C(C=C1)CCNC(=O)C2C3=CC=CC=C3CCO2)OC
InChI=1SC20H23NO4c123178714(1318(17)242)9112120(22)1916643515(16)10122519h381319H912H212H3(H2122)
MFCD05860264
N(2(34dimethoxyphenyl)ethyl)34dihydro1Hisochromene1carboxamide
N(2(34DIMETHOXYPHENYL)ETHYL)ISOCHROMANYLCARBOXAMIDE
ZINC000000528975
ZINC000000528977

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Available files

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