Vitas-M small molecule compound
3-[(2-benzylphenyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK475097
SMILES O=C(C1C2C=CC(C1C(=O)O)O2)Nc1ccccc1Cc1ccccc1
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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 C21H19NO4 MW 349.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO4/c23-20(18-16-10-11-17(26-16)19(18)21(24)25)22-15-9-5-4-8-14(15)12-13-6-2-1-3-7-13/h1-11,16-19H,12H2,(H,22,23)(H,24,25)InChIKey
KXJOPPHFFLVPIZ-UHFFFAOYSA-NSynonyms
2((2benzylphenyl)carbamoyl)7oxabicyclo(221)hept5ene3carboxylicacid
3((2benzylphenyl)carbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(N(2BENZYLPHENYL)CARBAMOYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)C3C4C=CC(C3C(=O)O)O4
InChI=1SC21H19NO4c2320(1816101117(2616)19(18)21(24)25)2215954814(15)12136213713h1111619H12H2(H2223)(H2425)
MFCD06065037
ZINC000225789463
ZINC000239338671
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