Vitas-M small molecule compound

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

Catalog ID
STK117676
SMILES CCOC(=O)C1Cc2ccccc2CN1Cc1ccc(cc1)C(C)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 C22H27NO2 MW 337.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO2/c1-4-25-22(24)21-13-19-7-5-6-8-20(19)15-23(21)14-17-9-11-18(12-10-17)16(2)3/h5-12,16,21H,4,13-15H2,1-3H3
InChIKey
GXJRKEFKKLRLEN-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1CC2=CC=CC=C2CN1CC3=CC=C(C=C3)C(C)C
ETHYL2((4PROPAN2YLPHENYL)METHYL)34DIHYDRO1HISOQUINOLINE3CARBOXYLATE
ethyl2(4(propan2yl)benzyl)1234tetrahydroisoquinoline3carboxylate
InChI=1SC22H27NO2c142522(24)211319756820(19)1523(21)141791118(121017)16(2)3h5121621H41315H213H3
MFCD08675319
ZINC000036127390
ZINC000036127391

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Available files

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