Vitas-M small molecule compound
methyl 4-[(1E)-3-(4-chlorophenyl)-3-oxoprop-1-en-1-yl]benzoate
Catalog ID
STL372322
SMILES COC(=O)c1ccc(cc1)/C=C/C(=O)c1ccc(cc1)Cl
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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 C17H13ClO3 MW 300.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClO3/c1-21-17(20)14-5-2-12(3-6-14)4-11-16(19)13-7-9-15(18)10-8-13/h2-11H,1H3/b11-4+InChIKey
CPFXPUUECOSZEA-NYYWCZLTSA-NSynonyms
COC(=O)C1=CC=C(C=C1)C=CC(=O)C2=CC=C(C=C2)Cl
COC(=O)c1ccc(cc1)C=CC(=O)c1ccc(cc1)Cl
InChI=1SC17H13ClO3c12117(20)145212(3614)41116(19)137915(18)10813h211H1H3b114+
methyl4((1E)3(4chlorophenyl)3oxoprop1en1yl)benzoate
METHYL4((1E)3(4CHLOROPHENYL)3OXOPROP1ENYL)BENZOATE
METHYL4((E)3(4CHLOROPHENYL)3OXOPROP1ENYL)BENZOATE
MFCD01901344
ZINC000005069000
ZINC05069000
ZINC5069000
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