Vitas-M small molecule compound
4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-2,7,7-trimethyl-3-(morpholin-4-ylcarbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Catalog ID
STK403776
SMILES CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)N1CCOCC1
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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 C25H31N3O7 MW 485.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O7/c1-5-35-19-11-15(10-17(23(19)30)28(32)33)21-20(24(31)27-6-8-34-9-7-27)14(2)26-16-12-25(3,4)13-18(29)22(16)21/h10-11,21,26,30H,5-9,12-13H2,1-4H3InChIKey
CFWYNVXCYPBIRV-UHFFFAOYSA-NSynonyms
4(3ethoxy4hydroxy5nitrophenyl)277trimethyl3(morpholin4ylcarbonyl)4678tetrahydroquinolin5(1H)one
4(3ethoxy4hydroxy5nitrophenyl)277trimethyl3(morpholine4carbonyl)1468tetrahydroquinolin5one
CCOC1=CC(=CC(=C1O)(N+)(=O)(O))C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)N4CCOCC4)C
CCOc1cc(cc(c1O)(N+)(=O)(O))C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)N1CCOCC1
InChI=1SC25H31N3O7c1535191115(1017(23(19)30)28(32)33)2120(24(31)2768349727)14(2)26161225(34)1318(29)22(16)21h1011212630H591213H214H3
MFCD03632508
ZINC000020175571
ZINC000020175572
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