Vitas-M small molecule compound

2,6,6-trimethyl-1-(2-methyl-5-nitrophenyl)-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one

Catalog ID
STK765458
SMILES Cc1ccc(cc1n1c(C)c(c2c1CC(C)(C)CC2=O)CC(Cl)(Cl)Cl)[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 C20H21Cl3N2O3 MW 443.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl3N2O3/c1-11-5-6-13(25(27)28)7-15(11)24-12(2)14(8-20(21,22)23)18-16(24)9-19(3,4)10-17(18)26/h5-7H,8-10H2,1-4H3
InChIKey
RFOHGBBUROADQV-UHFFFAOYSA-N
Synonyms

266trimethyl1(2methyl5nitrophenyl)3(222trichloroethyl)1567tetrahydro4Hindol4one
266TRIMETHYL1(2METHYL5NITROPHENYL)3(222TRICHLOROETHYL)57DIHYDROINDOL4ONE
CC1=C(C=C(C=C1)(N+)(=O)(O))N2C(=C(C3=C2CC(CC3=O)(C)C)CC(Cl)(Cl)Cl)C
Cc1ccc(cc1n1c(C)c(c2c1CC(C)(C)CC2=O)CC(Cl)(Cl)Cl)(N+)(=O)(O)
InChI=1SC20H21Cl3N2O3c1115613(25(27)28)715(11)2412(2)14(820(2122)23)1816(24)919(34)1017(18)26h57H810H214H3
MFCD02933712
ZINC000001068160
ZINC01068160
ZINC1068160

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Available files

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