Vitas-M small molecule compound
3-methylbenzyl 2-ethoxy-4-oxo-4,6,7,8,9,10-hexahydropyrido[1,2-a]azepine-1-carboxylate
Catalog ID
STL135679
SMILES CCOc1cc(=O)n2c(c1C(=O)OCc1cccc(c1)C)CCCCC2
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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 C21H25NO4 MW 355.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO4/c1-3-25-18-13-19(23)22-11-6-4-5-10-17(22)20(18)21(24)26-14-16-9-7-8-15(2)12-16/h7-9,12-13H,3-6,10-11,14H2,1-2H3InChIKey
FEFJDDFZFASJML-UHFFFAOYSA-NSynonyms
1326928-08-8(3methylphenyl)methyl2ethoxy4oxo78910tetrahydro6Hpyrido(12a)azepine1carboxylate
1326928088
3methylbenzyl2ethoxy4oxo4678910hexahydropyrido(12a)azepine1carboxylate
CCOC1=CC(=O)N2CCCCCC2=C1C(=O)OCC3=CC=CC(=C3)C
InChI=1SC21H25NO4c1325181319(23)22116451017(22)20(18)21(24)26141697815(2)1216h791213H36101114H212H3
MFCD20754508
ZINC000067350343
ZINC67350343
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