Vitas-M small molecule compound
methyl 3-(3,4-dihydroquinolin-1(2H)-ylcarbonyl)-5-nitrobenzoate
Catalog ID
STK100287
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)N1CCCc2c1cccc2
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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)14-9-13(10-15(11-14)20(23)24)17(21)19-8-4-6-12-5-2-3-7-16(12)19/h2-3,5,7,9-11H,4,6,8H2,1H3InChIKey
KNBONNIXFAAKLE-UHFFFAOYSA-NSynonyms
329932-14-1329932141
COC(=O)C1=CC(=CC(=C1)C(=O)N2CCCC3=CC=CC=C32)(N+)(=O)(O)
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)N1CCCc2c1cccc2
InChI=1SC18H16N2O5c12518(22)14913(1015(1114)20(23)24)17(21)1984612523716(12)19h2357911H468H21H3
METHYL3(34DIHYDRO2HQUINOLINE1CARBONYL)5NITROBENZOATE
METHYL3(34DIHYDROQUINOLIN1(2H)YLCARBONYL)5NITROBENZOATE
MFCD01196979
ZINC000000060847
ZINC00060847
ZINC60847
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