Vitas-M small molecule compound

1-(3,4-dihydro-1H-isochromen-1-yl)-N-[(E)-(2,4,5-trimethoxyphenyl)methylidene]methanamine

Catalog ID
STL286843
SMILES COc1cc(OC)c(cc1/C=N/CC1OCCc2c1cccc2)OC

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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/c1-22-17-11-19(24-3)18(23-2)10-15(17)12-21-13-20-16-7-5-4-6-14(16)8-9-25-20/h4-7,10-12,20H,8-9,13H2,1-3H3/b21-12+
InChIKey
IQKQNFKKKWZNTI-CIAFOILYSA-N
Synonyms
339346-38-2
(E)1(isochroman1yl)N(245trimethoxybenzylidene)methanamine
1(34dihydro1Hisochromen1yl)N((E)(245trimethoxyphenyl)methylidene)methanamine
339346382
COc1cc(OC)c(cc1C=NCC1OCCc2c1cccc2)OC
MFCD01175143
ZINC000000174651
ZINC000000174653

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Available files

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