Vitas-M small molecule compound
2-chloro-N-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]acetamide
Catalog ID
STL367560
SMILES ClCC(=O)NCc1cc2OCCCOc2cc1C
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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 C13H16ClNO3 MW 269.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16ClNO3/c1-9-5-11-12(18-4-2-3-17-11)6-10(9)8-15-13(16)7-14/h5-6H,2-4,7-8H2,1H3,(H,15,16)InChIKey
YGTOVIXRQSLUKV-UHFFFAOYSA-NSynonyms
2chloroN((8methyl34dihydro2H15benzodioxepin7yl)methyl)acetamide
CC1=CC2=C(C=C1CNC(=O)CCl)OCCCO2
InChI=1SC13H16ClNO3c1951112(184231711)610(9)81513(16)714h56H2478H21H3(H1516)
MFCD27966389
ZINC000097896994
ZINC97896994
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