Vitas-M small molecule compound
4-(4-chloro-3-nitrophenyl)-7-(2-chlorophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Catalog ID
STK406781
SMILES O=C1NC2=C(C(C1)c1ccc(c(c1)[N+](=O)[O-])Cl)C(=O)CC(C2)c1ccccc1Cl
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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 C21H16Cl2N2O4 MW 431.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl2N2O4/c22-15-4-2-1-3-13(15)12-7-17-21(19(26)9-12)14(10-20(27)24-17)11-5-6-16(23)18(8-11)25(28)29/h1-6,8,12,14H,7,9-10H2,(H,24,27)InChIKey
UJTHIHCNSPWZIX-UHFFFAOYSA-NSynonyms
4(4chloro3nitrophenyl)7(2chlorophenyl)134678hexahydroquinoline25dione
4(4chloro3nitrophenyl)7(2chlorophenyl)4678tetrahydroquinoline25(1H3H)dione
C1C(CC(=O)C2=C1NC(=O)CC2C3=CC(=C(C=C3)Cl)(N+)(=O)(O))C4=CC=CC=C4Cl
InChI=1SC21H16Cl2N2O4c2215421313(15)1271721(19(26)912)14(1020(27)2417)115616(23)18(811)25(28)29h1681214H7910H2(H2427)
MFCD07613353
O=C1NC2=C(C(C1)c1ccc(c(c1)(N+)(=O)(O))Cl)C(=O)CC(C2)c1ccccc1Cl
ZINC000017097353
ZINC000017097356
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