Vitas-M small molecule compound
methyl 3-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-5-nitrobenzoate
Catalog ID
STK096298
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N1CCc2c(C1)cccc2
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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 C18H16N2O5 MW 340.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O5/c1-25-18(22)15-8-14(9-16(10-15)20(23)24)17(21)19-7-6-12-4-2-3-5-13(12)11-19/h2-5,8-10H,6-7,11H2,1H3InChIKey
QJGHVXMGXNTTIW-UHFFFAOYSA-NSynonyms
328284-57-73(34DIHYDRO1HISOQUINOLINE2CARBONYL)5NITROBENZOICACIDMETHYLESTER
328284577
COC(=O)C1=CC(=CC(=C1)C(=O)N2CCC3=CC=CC=C3C2)(N+)(=O)(O)
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)N1CCc2c(C1)cccc2
InChI=1SC18H16N2O5c12518(22)15814(916(1015)20(23)24)17(21)197612423513(12)1119h25810H6711H21H3
METHYL3(34DIHYDRO1HISOQUINOLINE2CARBONYL)5NITROBENZOATE
METHYL3(34DIHYDROISOQUINOLIN2(1H)YLCARBONYL)5NITROBENZOATE
MFCD01196956
STK096298
ZINC000000060834
ZINC00060834
ZINC60834
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