Vitas-M small molecule compound

benzyl (7,8-dimethoxy-2-oxo-1,2-dihydro-3H-3-benzazepin-3-yl)acetate

Catalog ID
STL320571
SMILES COc1cc2C=CN(C(=O)Cc2cc1OC)CC(=O)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 C21H21NO5 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5/c1-25-18-10-16-8-9-22(20(23)12-17(16)11-19(18)26-2)13-21(24)27-14-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3
InChIKey
IVCDCYGLPIPIMP-UHFFFAOYSA-N
Synonyms
1574307-85-9
1574307859
benzyl(78dimethoxy2oxo12dihydro3H3benzazepin3yl)acetate
benzyl2(78dimethoxy2oxo1H3benzazepin3yl)acetate
benzyl2(78dimethoxy2oxo1Hbenzo(d)azepin3(2H)yl)acetate
COC1=C(C=C2C=CN(C(=O)CC2=C1)CC(=O)OCC3=CC=CC=C3)OC
InChI=1SC21H21NO5c1251810168922(20(23)1217(16)1119(18)262)1321(24)2714156435715h311H1214H212H3
MFCD28029571
ZINC000095480906
ZINC95480906

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Available files

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