Vitas-M small molecule compound

tert-butyl 1,5-dihydroxy-8,9-dimethoxy-3-methyl-5H-2-benzazepine-4-carboxylate

Catalog ID
STL528591
SMILES COc1c(OC)ccc2c1C(=NC(=C(C2O)C(=O)OC(C)(C)C)C)O

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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 C18H23NO6 MW 349.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO6/c1-9-12(17(22)25-18(2,3)4)14(20)10-7-8-11(23-5)15(24-6)13(10)16(21)19-9/h7-8,14,20H,1-6H3,(H,19,21)
InChIKey
FHDMPYQQICMIRR-UHFFFAOYSA-N
Synonyms
243978-07-6
~(tert)butyl5hydroxy89dimethoxy3methyl1oxo25dihydro2benzazepine4carboxylate
243978076
2962022
InChI=1SC18H23NO6c1912(17(22)2518(23)4)14(20)107811(235)15(246)13(10)16(21)199h781420H16H3(H1921)
MFCD03793730
tertbutyl15dihydroxy89dimethoxy3methyl5H2benzazepine4carboxylate
TERTBUTYL5HYDROXY89DIMETHOXY3METHYL1OXO25DIHYDRO2BENZAZEPINE4CARBOXYLATE
ZINC000001293536
ZINC000001293537

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Available files

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