Vitas-M small molecule compound
2-phenylethyl 2-methyl-4-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK376778
SMILES O=C(C1=C(C)NC2=C(C1c1ccc(cc1)[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)32-15-14-17-6-3-2-4-7-17)23(18-10-12-19(13-11-18)27(30)31)24-20(26-16)8-5-9-21(24)28/h2-4,6-7,10-13,23,26H,5,8-9,14-15H2,1H3InChIKey
LPRKNXLMYOXJIR-UHFFFAOYSA-NSynonyms
313244-74-52phenylethyl2methyl4(4nitrophenyl)5oxo145678hexahydroquinoline3carboxylate
2phenylethyl2methyl4(4nitrophenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
313244745
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)(N+)(=O)(O))C(=O)OCCC4=CC=CC=C4
InChI=1SC25H24N2O5c11622(25(29)321514176324717)23(18101219(131118)27(30)31)2420(2616)85921(24)28h246710132326H5891415H21H3
MFCD01367247
O=C(C1=C(C)NC2=C(C1c1ccc(cc1)(N+)(=O)(O))C(=O)CCC2)OCCc1ccccc1
ZINC000019827936
ZINC000019827938
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