Vitas-M small molecule compound
2-phenylethyl 2-methyl-4-(2-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402329
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1[N+](=O)[O-])C(=O)CCC2)OCCc1ccccc1
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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 C25H24N2O5 MW 432.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O5/c1-16-22(25(29)32-15-14-17-8-3-2-4-9-17)23(18-10-5-6-12-20(18)27(30)31)24-19(26-16)11-7-13-21(24)28/h2-6,8-10,12,23,26H,7,11,13-15H2,1H3InChIKey
PXTBMQHHNHQJBP-UHFFFAOYSA-NSynonyms
313244-76-72phenylethyl2methyl4(2nitrophenyl)5oxo145678hexahydroquinoline3carboxylate
2phenylethyl2methyl4(2nitrophenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
313244767
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC=C3(N+)(=O)(O))C(=O)OCCC4=CC=CC=C4
InChI=1SC25H24N2O5c11622(25(29)321514178324917)23(1810561220(18)27(30)31)2419(2616)1171321(24)28h26810122326H7111315H21H3
MFCD01367249
O=C(C1=C(C)NC2=C(C1c1ccccc1(N+)(=O)(O))C(=O)CCC2)OCCc1ccccc1
ZINC000000844234
ZINC000000844235
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