Vitas-M small molecule compound

methyl 4-oxo-4-(2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)butanoate

Catalog ID
STK736589
SMILES COC(=O)CCC(=O)N1CCCCc2c1cccc2

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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 C15H19NO3 MW 261.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19NO3/c1-19-15(18)10-9-14(17)16-11-5-4-7-12-6-2-3-8-13(12)16/h2-3,6,8H,4-5,7,9-11H2,1H3
InChIKey
ADFCDJCAVLNKPE-UHFFFAOYSA-N
Synonyms

COC(=O)CCC(=O)N1CCCCC2=CC=CC=C21
InChI=1SC15H19NO3c11915(18)10914(17)161154712623813(12)16h2368H457911H21H3
METHYL4(2H3H4H5HBENZO(F)AZEPINYL)4OXOBUTANOATE
methyl4oxo4(2345tetrahydro1benzazepin1yl)butanoate
methyl4oxo4(2345tetrahydro1H1benzazepin1yl)butanoate
MFCD07800508
ZINC000004788915
ZINC04788915
ZINC4788915

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Available files

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