Vitas-M small molecule compound
(2E)-1-(4-ethylphenyl)-3-[5-(4-nitrophenyl)furan-2-yl]prop-2-en-1-one
Catalog ID
STK949156
SMILES CCc1ccc(cc1)C(=O)/C=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-]
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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 C21H17NO4 MW 347.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO4/c1-2-15-3-5-16(6-4-15)20(23)13-11-19-12-14-21(26-19)17-7-9-18(10-8-17)22(24)25/h3-14H,2H2,1H3/b13-11+InChIKey
NWWZYMJSLWSMBV-ACCUITESSA-NSynonyms
(2E)1(4ETHYLPHENYL)3(5(4NITROPHENYL)(2FURYL))PROP2EN1ONE
(2E)1(4ethylphenyl)3(5(4nitrophenyl)furan2yl)prop2en1one
(E)1(4ETHYLPHENYL)3(5(4NITROPHENYL)FURAN2YL)PROP2EN1ONE
CCC1=CC=C(C=C1)C(=O)C=CC2=CC=C(O2)C3=CC=C(C=C3)(N+)(=O)(O)
CCc1ccc(cc1)C(=O)C=Cc1ccc(o1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC21H17NO4c12153516(6415)20(23)131119121421(2619)177918(10817)22(24)25h314H2H21H3b1311+
MFCD02107033
ZINC000005061180
ZINC05061180
ZINC5061180
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