Vitas-M small molecule compound

cycloheptyl 4-(4-chlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK402912
SMILES Clc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCCCC1

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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 C24H28ClNO3 MW 413.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28ClNO3/c1-15-21(24(28)29-18-7-4-2-3-5-8-18)22(16-11-13-17(25)14-12-16)23-19(26-15)9-6-10-20(23)27/h11-14,18,22,26H,2-10H2,1H3
InChIKey
OSHQRTNONRKEIG-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=C(C=C3)Cl)C(=O)OC4CCCCCC4
cycloheptyl4(4chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cycloheptyl4(4chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC24H28ClNO3c11521(24(28)291874235818)22(16111317(25)141216)2319(2615)961020(23)27h1114182226H210H21H3
MFCD03145572
ZINC000001074555
ZINC000001074561

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.