Vitas-M small molecule compound

(3E)-5-(4-bromophenyl)-3-{[5-(2-nitrophenyl)furan-2-yl]methylidene}furan-2(3H)-one

Catalog ID
STK200536
SMILES Brc1ccc(cc1)C1=C/C(=C\c2ccc(o2)c2ccccc2[N+](=O)[O-])/C(=O)O1

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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 C21H12BrNO5 MW 438.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12BrNO5/c22-15-7-5-13(6-8-15)20-12-14(21(24)28-20)11-16-9-10-19(27-16)17-3-1-2-4-18(17)23(25)26/h1-12H/b14-11+
InChIKey
MBXFZQVJSJEHLQ-SDNWHVSQSA-N
Synonyms

(3E)5(4BROMOPHENYL)3((5(2NITROPHENYL)FURAN2YL)METHYLIDENE)FURAN2(3H)ONE
(3E)5(4BROMOPHENYL)3((5(2NITROPHENYL)FURAN2YL)METHYLIDENE)FURAN2ONE
(E)5(4bromophenyl)3((5(2nitrophenyl)furan2yl)methylene)furan2(3H)one
Brc1ccc(cc1)C1=CC(=Cc2ccc(o2)c2ccccc2(N+)(=O)(O))C(=O)O1
C1=CC=C(C(=C1)C2=CC=C(O2)C=C3C=C(OC3=O)C4=CC=C(C=C4)Br)(N+)(=O)(O)
InChI=1SC21H12BrNO5c22157513(6815)201214(21(24)2820)111691019(2716)17312418(17)23(25)26h112Hb1411+
MFCD02194863
ZINC000001206696
ZINC01206696
ZINC1206696

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Available files

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