Vitas-M small molecule compound

methyl 4-[(1-benzoxepin-4-ylcarbonyl)amino]benzoate

Catalog ID
STK867643
SMILES COC(=O)c1ccc(cc1)NC(=O)C1=Cc2ccccc2OC=C1

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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 C19H15NO4 MW 321.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15NO4/c1-23-19(22)13-6-8-16(9-7-13)20-18(21)15-10-11-24-17-5-3-2-4-14(17)12-15/h2-12H,1H3,(H,20,21)
InChIKey
NBQNIOILTBVYSW-UHFFFAOYSA-N
Synonyms
924838-49-3
924838493
COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3OC=C2
InChI=1SC19H15NO4c12319(22)136816(9713)2018(21)1510112417532414(17)1215h212H1H3(H2021)
methyl4((1benzoxepin4ylcarbonyl)amino)benzoate
methyl4(1benzoxepine4carbonylamino)benzoate
METHYL4(BENZO(B)OXEPIN4YLCARBONYLAMINO)BENZOATE
methyl4(benzo(b)oxepine4carboxamido)benzoate
MFCD09759944
ZINC000011689856
ZINC11689856

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Available files

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