Vitas-M small molecule compound
butan-2-yl 6-(4-ethoxyphenyl)-3-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indole-2-carboxylate
Catalog ID
STK775311
SMILES CCOc1ccc(cc1)C1CC(=O)c2c(C1)[nH]c(c2C)C(=O)OC(CC)C
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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 C22H27NO4 MW 369.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO4/c1-5-13(3)27-22(25)21-14(4)20-18(23-21)11-16(12-19(20)24)15-7-9-17(10-8-15)26-6-2/h7-10,13,16,23H,5-6,11-12H2,1-4H3InChIKey
YBSQWUNMMYRDHT-UHFFFAOYSA-NSynonyms
butan2yl6(4ethoxyphenyl)3methyl4oxo1567tetrahydroindole2carboxylate
butan2yl6(4ethoxyphenyl)3methyl4oxo4567tetrahydro1Hindole2carboxylate
CCC(C)OC(=O)C1=C(C2=C(N1)CC(CC2=O)C3=CC=C(C=C3)OCC)C
CCOc1ccc(cc1)C1CC(=O)c2c(C1)(nH)c(c2C)C(=O)OC(CC)C
InChI=1SC22H27NO4c1513(3)2722(25)2114(4)2018(2321)1116(1219(20)24)157917(10815)2662h710131623H561112H214H3
MFCD05257108
ZINC000001422020
ZINC000004686298
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