Vitas-M small molecule compound
2-ethoxyethyl 4-(4-ethylphenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402484
SMILES CCOCCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)CC)C(=O)CC(C2)c1ccccc1
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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 C29H33NO4 MW 459.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO4/c1-4-20-11-13-22(14-12-20)27-26(29(32)34-16-15-33-5-2)19(3)30-24-17-23(18-25(31)28(24)27)21-9-7-6-8-10-21/h6-14,23,27,30H,4-5,15-18H2,1-3H3InChIKey
MJTJOCBLDSWGLW-UHFFFAOYSA-NSynonyms
2ethoxyethyl4(4ethylphenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
2ethoxyethyl4(4ethylphenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
CCC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)OCCOCC)C
InChI=1SC29H33NO4c1420111322(141220)2726(29(32)3416153352)19(3)30241723(1825(31)28(24)27)2197681021h614232730H451518H213H3
MFCD01590163
ZINC000009600800
ZINC000009600803
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