Vitas-M small molecule compound
cyclohexyl 4-(3-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372495
SMILES Clc1cccc(c1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCCC1
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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 C25H30ClNO3 MW 427.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30ClNO3/c1-15-21(24(29)30-18-10-5-4-6-11-18)22(16-8-7-9-17(26)12-16)23-19(27-15)13-25(2,3)14-20(23)28/h7-9,12,18,22,27H,4-6,10-11,13-14H2,1-3H3InChIKey
CDOAWUQVYHTJJX-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC(=CC=C3)Cl)C(=O)OC4CCCCC4
cyclohexyl4(3chlorophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
cyclohexyl4(3chlorophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
InChI=1SC25H30ClNO3c11521(24(29)3018105461118)22(1687917(26)1216)2319(2715)1325(23)1420(23)28h7912182227H4610111314H213H3
MFCD00717896
ZINC000002069366
ZINC000002069367
Check stock
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Check stock on Vitas-MAvailable files
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