Vitas-M small molecule compound

7,7-dimethyl-2,5-dioxo-4-phenyl-1,2,3,4,5,6,7,8-octahydroquinoline-3-carbonitrile

Catalog ID
STK290939
SMILES N#CC1C(=O)NC2=C(C1c1ccccc1)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 C18H18N2O2 MW 294.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O2/c1-18(2)8-13-16(14(21)9-18)15(11-6-4-3-5-7-11)12(10-19)17(22)20-13/h3-7,12,15H,8-9H2,1-2H3,(H,20,22)
InChIKey
NGUXDLYFLLKSTH-UHFFFAOYSA-N
Synonyms
300844-19-3
300844193
77dimethyl25dioxo4phenyl12345678octahydroquinoline3carbonitrile
77dimethyl25dioxo4phenyl3468tetrahydro1Hquinoline3carbonitrile
CC1(CC2=C(C(C(C(=O)N2)C#N)C3=CC=CC=C3)C(=O)C1)C
InChI=1SC18H18N2O2c118(2)81316(14(21)918)15(116435711)12(1019)17(22)2013h371215H89H212H3(H2022)
MFCD00741979
ZINC000000493822
ZINC000000493825

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Available files

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