Vitas-M small molecule compound

3-[(3-bromophenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid

Catalog ID
STK421841
SMILES O=C(C1C2C=CC(C1C(=O)O)O2)Nc1cccc(c1)Br

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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 C14H12BrNO4 MW 338.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12BrNO4/c15-7-2-1-3-8(6-7)16-13(17)11-9-4-5-10(20-9)12(11)14(18)19/h1-6,9-12H,(H,16,17)(H,18,19)
InChIKey
TWEGMXZXLULBRO-UHFFFAOYSA-N
Synonyms
491831-77-7
2((3BROMOPHENYL)CARBAMOYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((3BROMOANILINO)CARBONYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
3((3bromophenyl)carbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
491831777
C1=CC(=CC(=C1)Br)NC(=O)C2C3C=CC(C2C(=O)O)O3
InChI=1SC14H12BrNO4c1572138(67)1613(17)1194510(209)12(11)14(18)19h16912H(H1617)(H1819)
MFCD01338961
ZINC000169619860
ZINC000245227955

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Available files

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