Vitas-M small molecule compound

N-(4-acetylphenyl)-7-bromo-1-benzoxepine-4-carboxamide

Catalog ID
STK865038
SMILES Brc1ccc2c(c1)C=C(C=CO2)C(=O)Nc1ccc(cc1)C(=O)C

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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 C19H14BrNO3 MW 384.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrNO3/c1-12(22)13-2-5-17(6-3-13)21-19(23)14-8-9-24-18-7-4-16(20)11-15(18)10-14/h2-11H,1H3,(H,21,23)
InChIKey
QAKJEEUMYZRVEX-UHFFFAOYSA-N
Synonyms
950426-66-1
950426661
CC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC=C2
InChI=1SC19H14BrNO3c112(22)132517(6313)2119(23)148924187416(20)1115(18)1014h211H1H3(H2123)
MFCD10082153
N(4ACETYLPHENYL)(7BROMOBENZO(B)OXEPIN4YL)CARBOXAMIDE
N(4acetylphenyl)7bromo1benzoxepine4carboxamide
N(4ACETYLPHENYL)7BROMOBENZO(B)OXEPINE4CARBOXAMIDE
ZINC000012274590
ZINC12274590

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Available files

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