Vitas-M small molecule compound

ethyl 2-[3-(benzyloxy)benzyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylate

Catalog ID
STK115659
SMILES CCOC(=O)C1Cc2ccccc2CN1Cc1cccc(c1)OCc1ccccc1

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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 C26H27NO3 MW 401.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO3/c1-2-29-26(28)25-16-22-12-6-7-13-23(22)18-27(25)17-21-11-8-14-24(15-21)30-19-20-9-4-3-5-10-20/h3-15,25H,2,16-19H2,1H3
InChIKey
NERRDFXHHNCTDC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1CC2=CC=CC=C2CN1CC3=CC(=CC=C3)OCC4=CC=CC=C4
ETHYL2((3PHENYLMETHOXYPHENYL)METHYL)34DIHYDRO1HISOQUINOLINE3CARBOXYLATE
ethyl2(3(benzyloxy)benzyl)1234tetrahydroisoquinoline3carboxylate
InChI=1SC26H27NO3c122926(28)25162212671323(22)1827(25)17211181424(1521)30192094351020h31525H21619H21H3
MFCD09267366
ZINC000012628948
ZINC000012628951

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Available files

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