Vitas-M small molecule compound
ethyl 3-oxo-1,2,3,7,8,12b-hexahydro[1,4]diazepino[2,1-a]isoquinoline-5-carboxylate
Catalog ID
STL433915
SMILES CCOC(=O)C1=CC(=O)NCC2N1CCc1c2cccc1
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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 C16H18N2O3 MW 286.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O3/c1-2-21-16(20)13-9-15(19)17-10-14-12-6-4-3-5-11(12)7-8-18(13)14/h3-6,9,14H,2,7-8,10H2,1H3,(H,17,19)InChIKey
UJCCAFWXHZPCJC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC(=O)NCC2N1CCC3=CC=CC=C23
ethyl3oxo1237812bhexahydro(14)diazepino(21a)isoquinoline5carboxylate
ethyl3oxo27812btetrahydro1H(14)diazepino(21a)isoquinoline5carboxylate
InChI=1SC16H18N2O3c122116(20)13915(19)17101412643511(12)7818(13)14h36914H27810H21H3(H1719)
MFCD26098182
ZINC000032169431
ZINC000032169434
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