Vitas-M small molecule compound
(2E)-3-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-1-[4-(propan-2-yloxy)phenyl]prop-2-en-1-one
Catalog ID
STK949650
SMILES CC(Oc1ccc(cc1)C(=O)/C=C/c1ccc(o1)c1ccc(c(c1)[N+](=O)[O-])Cl)C
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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 C22H18ClNO5 MW 411.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClNO5/c1-14(2)28-17-6-3-15(4-7-17)21(25)11-8-18-9-12-22(29-18)16-5-10-19(23)20(13-16)24(26)27/h3-14H,1-2H3/b11-8+InChIKey
UBYLNJGLVULAMB-DHZHZOJOSA-NSynonyms
(2E)3(5(4CHLORO3NITROPHENYL)(2FURYL))1(4(METHYLETHOXY)PHENYL)PROP2EN1ONE
(2E)3(5(4chloro3nitrophenyl)furan2yl)1(4(propan2yloxy)phenyl)prop2en1one
(E)3(5(4CHLORO3NITROPHENYL)FURAN2YL)1(4PROPAN2YLOXYPHENYL)PROP2EN1ONE
CC(C)OC1=CC=C(C=C1)C(=O)C=CC2=CC=C(O2)C3=CC(=C(C=C3)Cl)(N+)(=O)(O)
CC(Oc1ccc(cc1)C(=O)C=Cc1ccc(o1)c1ccc(c(c1)(N+)(=O)(O))Cl)C
InChI=1SC22H18ClNO5c114(2)28176315(4717)21(25)1181891222(2918)1651019(23)20(1316)24(26)27h314H12H3b118+
MFCD02371055
ZINC000005012101
ZINC05012101
ZINC5012101
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