Vitas-M small molecule compound
4-(1,3-benzodioxol-5-yl)-7-(3-methoxyphenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Catalog ID
STK407071
SMILES COc1cccc(c1)C1CC(=O)C2=C(C1)NC(=O)CC2c1ccc2c(c1)OCO2
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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 C23H21NO5 MW 391.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO5/c1-27-16-4-2-3-13(7-16)15-8-18-23(19(25)9-15)17(11-22(26)24-18)14-5-6-20-21(10-14)29-12-28-20/h2-7,10,15,17H,8-9,11-12H2,1H3,(H,24,26)InChIKey
MLXGAGAZYATENN-UHFFFAOYSA-NSynonyms
879048-29-04(13benzodioxol5yl)7(3methoxyphenyl)134678hexahydroquinoline25dione
4(13benzodioxol5yl)7(3methoxyphenyl)4678tetrahydroquinoline25(1H3H)dione
879048290
COC1=CC=CC(=C1)C2CC3=C(C(CC(=O)N3)C4=CC5=C(C=C4)OCO5)C(=O)C2
InChI=1SC23H21NO5c1271642313(716)1581823(19(25)915)17(1122(26)2418)14562021(1014)29122820h27101517H891112H21H3(H2426)
MFCD07402629
ZINC000004987512
ZINC000004987516
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