Vitas-M small molecule compound

4,9-dimethoxy-7-methyl-5-(4-nitrophenyl)-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinoline

Catalog ID
STL433702
SMILES COc1c2C(=NC(Cc2c(c2c1OCO2)OC)C)c1ccc(cc1)[N+](=O)[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 C19H18N2O6 MW 370.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O6/c1-10-8-13-14(15(20-10)11-4-6-12(7-5-11)21(22)23)17(25-3)19-18(16(13)24-2)26-9-27-19/h4-7,10H,8-9H2,1-3H3
InChIKey
UHAQNGQFWYTADT-UHFFFAOYSA-N
Synonyms

49dimethoxy7methyl5(4nitrophenyl)78dihydro(13)dioxolo(45g)isoquinoline
CC1CC2=C(C(=C3C(=C2OC)OCO3)OC)C(=N1)C4=CC=C(C=C4)(N+)(=O)(O)
COc1c2C(=NC(Cc2c(c2c1OCO2)OC)C)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H18N2O6c11081314(15(2010)114612(7511)21(22)23)17(253)1918(16(13)242)2692719h4710H89H213H3
MFCD25976051
ZINC000066091675
ZINC000066091676

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Available files

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