Vitas-M small molecule compound
4-(4-chloro-3-nitrophenyl)-7-(3,4-dimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Catalog ID
STK406606
SMILES COc1ccc(cc1OC)C1CC(=O)C2=C(C1)NC(=O)CC2c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C23H21ClN2O6 MW 456.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O6/c1-31-20-6-4-12(10-21(20)32-2)14-7-17-23(19(27)9-14)15(11-22(28)25-17)13-3-5-16(24)18(8-13)26(29)30/h3-6,8,10,14-15H,7,9,11H2,1-2H3,(H,25,28)InChIKey
VSLPOVXEKZCGAA-UHFFFAOYSA-NSynonyms
4(4chloro3nitrophenyl)7(34dimethoxyphenyl)134678hexahydroquinoline25dione
4(4chloro3nitrophenyl)7(34dimethoxyphenyl)4678tetrahydroquinoline25(1H3H)dione
COC1=C(C=C(C=C1)C2CC3=C(C(CC(=O)N3)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))C(=O)C2)OC
COc1ccc(cc1OC)C1CC(=O)C2=C(C1)NC(=O)CC2c1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC23H21ClN2O6c131206412(1021(20)322)1471723(19(27)914)15(1122(28)2517)133516(24)18(813)26(29)30h368101415H7911H212H3(H2528)
MFCD07613234
ZINC000020258953
ZINC000020258959
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