Vitas-M small molecule compound
4-[(1E)-2-cyano-3-oxo-3-phenylprop-1-en-1-yl]phenyl 4-bromobenzoate
Catalog ID
STK077992
SMILES N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)Br)/C(=O)c1ccccc1
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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 C23H14BrNO3 MW 432.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H14BrNO3/c24-20-10-8-18(9-11-20)23(27)28-21-12-6-16(7-13-21)14-19(15-25)22(26)17-4-2-1-3-5-17/h1-14H/b19-14+InChIKey
IYEUJBVCXDERCB-XMHGGMMESA-NSynonyms
(4((E)2CYANO3OXO3PHENYLPROP1ENYL)PHENYL)4BROMOBENZOATE
4((1E)2CYANO3OXO3PHENYLPROP1EN1YL)PHENYL4BROMOBENZOATE
C1=CC=C(C=C1)C(=O)C(=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Br)C#N
InChI=1SC23H14BrNO3c242010818(91120)23(27)282112616(71321)1419(1525)22(26)174213517h114Hb1914+
MFCD02193198
N#CC(=Cc1ccc(cc1)OC(=O)c1ccc(cc1)Br)C(=O)c1ccccc1
STK077992
ZINC000009659940
ZINC09659940
ZINC9659940
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