Vitas-M small molecule compound

7,7-dimethyl-5-oxo-4-phenyl-1,4,5,6,7,8-hexahydroquinoline-2-carboxylic acid

Catalog ID
STL361694
SMILES OC(=O)C1=CC(C2=C(N1)CC(C)(C)CC2=O)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 C18H19NO3 MW 297.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO3/c1-18(2)9-14-16(15(20)10-18)12(8-13(19-14)17(21)22)11-6-4-3-5-7-11/h3-8,12,19H,9-10H2,1-2H3,(H,21,22)
InChIKey
SCDNFSRISGJXPH-UHFFFAOYSA-N
Synonyms
1233334-73-0
1233334730
77dimethyl5oxo4phenyl145678hexahydroquinoline2carboxylicacid
77dimethyl5oxo4phenyl1468tetrahydroquinoline2carboxylicacid
CC1(CC2=C(C(C=C(N2)C(=O)O)C3=CC=CC=C3)C(=O)C1)C
InChI=1SC18H19NO3c118(2)91416(15(20)1018)12(813(1914)17(21)22)116435711h381219H910H212H3(H2122)
MFCD22374925
ZINC000100161749
ZINC000100161753

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Available files

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