Vitas-M small molecule compound
3-[(3-chloro-4-methoxyphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK475026
SMILES COc1ccc(cc1Cl)NC(=O)C1C2C=CC(C1C(=O)O)O2
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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 C15H14ClNO5 MW 323.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14ClNO5/c1-21-9-3-2-7(6-8(9)16)17-14(18)12-10-4-5-11(22-10)13(12)15(19)20/h2-6,10-13H,1H3,(H,17,18)(H,19,20)InChIKey
CEHHARBVLAPYBK-UHFFFAOYSA-NSynonyms
2((3chloro4methoxyphenyl)carbamoyl)7oxabicyclo(221)hept5ene3carboxylicacid
3((3chloro4methoxyphenyl)carbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(N(3CHLORO4METHOXYPHENYL)CARBAMOYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
COC1=C(C=C(C=C1)NC(=O)C2C3C=CC(C2C(=O)O)O3)Cl
InChI=1SC15H14ClNO5c1219327(68(9)16)1714(18)12104511(2210)13(12)15(19)20h261013H1H3(H1718)(H1920)
MFCD06064378
ZINC000225788776
ZINC000239030657
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