Vitas-M small molecule compound

N-(4-methoxyphenyl)-8-methyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Catalog ID
STL430122
SMILES COc1ccc(cc1)NC(=O)c1cc2OCCCOc2cc1C

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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 C18H19NO4 MW 313.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4/c1-12-10-16-17(23-9-3-8-22-16)11-15(12)18(20)19-13-4-6-14(21-2)7-5-13/h4-7,10-11H,3,8-9H2,1-2H3,(H,19,20)
InChIKey
FRCLWVFPQMIEOY-UHFFFAOYSA-N
Synonyms

CC1=CC2=C(C=C1C(=O)NC3=CC=C(C=C3)OC)OCCCO2
InChI=1SC18H19NO4c112101617(239382216)1115(12)18(20)19134614(212)7513h471011H389H212H3(H1920)
MFCD27220773
N(4methoxyphenyl)8methyl34dihydro2H15benzodioxepine7carboxamide
ZINC000065315010
ZINC65315010

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.