Vitas-M small molecule compound

1-(4-hydroxyphenyl)-7,7-dimethyl-4-(4-nitrophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione

Catalog ID
STK759519
SMILES Oc1ccc(cc1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)[N+](=O)[O-]

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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 C23H22N2O5 MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O5/c1-23(2)12-19-22(20(27)13-23)18(14-3-5-16(6-4-14)25(29)30)11-21(28)24(19)15-7-9-17(26)10-8-15/h3-10,18,26H,11-13H2,1-2H3
InChIKey
RJRXBLCTYDBNFS-UHFFFAOYSA-N
Synonyms
154201-24-8
1(4hydroxyphenyl)77dimethyl4(4nitrophenyl)3468tetrahydroquinoline25dione
1(4hydroxyphenyl)77dimethyl4(4nitrophenyl)3478tetrahydroquinoline25(1H6H)dione
1(4hydroxyphenyl)77dimethyl4(4nitrophenyl)4678tetrahydroquinoline25(1H3H)dione
154201248
CC1(CC2=C(C(CC(=O)N2C3=CC=C(C=C3)O)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)C1)C
InChI=1SC23H22N2O5c123(2)121922(20(27)1323)18(143516(6414)25(29)30)1121(28)24(19)157917(26)10815h3101826H1113H212H3
MFCD01089086
Oc1ccc(cc1)N1C(=O)CC(C2=C1CC(C)(C)CC2=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000001436904
ZINC000001436905

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Available files

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