Vitas-M small molecule compound
3-[2-(4-chlorophenoxy)ethyl]-2-methyl-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carboxamide
Catalog ID
STL568756
SMILES NC(=O)C1C(=O)N(CCOc2ccc(cc2)Cl)C2(CC1c1ccccc1O2)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 C21H21ClN2O4 MW 400.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O4/c1-21-12-16(15-4-2-3-5-17(15)28-21)18(19(23)25)20(26)24(21)10-11-27-14-8-6-13(22)7-9-14/h2-9,16,18H,10-12H2,1H3,(H2,23,25)InChIKey
ANNSEUKFORMHGQ-UHFFFAOYSA-NSynonyms
10(2(4chlorophenoxy)ethyl)9methyl11oxo8oxa10azatricyclo(731027)trideca246triene12carboxamide
128963244
3(2(4chlorophenoxy)ethyl)2methyl4oxo3456tetrahydro2H26methano13benzoxazocine5carboxamide
3(2(4chlorophenoxy)ethyl)2methyl4oxo3456tetrahydro2H26methanobenzo(g)(13)oxazocine5carboxamide
InChI=1SC21H21ClN2O4c1211216(15423517(15)2821)18(19(23)25)20(26)24(21)101127148613(22)7914h291618H1012H21H3(H22325)
MFCD32653808
ZINC000524734391
ZINC000524734392
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