Vitas-M small molecule compound
ethyl 4-(4-ethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK063534
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)CC)C(=O)CC(C2)(C)C
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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 C23H29NO3 MW 367.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO3/c1-6-15-8-10-16(11-9-15)20-19(22(26)27-7-2)14(3)24-17-12-23(4,5)13-18(25)21(17)20/h8-11,20,24H,6-7,12-13H2,1-5H3InChIKey
BGSDYIABOHXRGX-UHFFFAOYSA-NSynonyms
294194-22-2294194222
CCC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OCC)C
CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)CC)C(=O)CC(C2)(C)C
ethyl4(4ethylphenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
ethyl4(4ethylphenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC23H29NO3c161581016(11915)2019(22(26)2772)14(3)24171223(45)1318(25)21(17)20h8112024H671213H215H3
MFCD00359962
STK063534
ZINC000003901617
ZINC000003901618
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