Vitas-M small molecule compound
(2E)-2-(1,3-benzoxazol-2-yl)-1-(4-methoxyphenyl)-3-(4-nitrophenyl)prop-2-en-1-one
Catalog ID
STK896811
SMILES COc1ccc(cc1)C(=O)/C(=C/c1ccc(cc1)[N+](=O)[O-])/c1nc2c(o1)cccc2
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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 C23H16N2O5 MW 400.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N2O5/c1-29-18-12-8-16(9-13-18)22(26)19(14-15-6-10-17(11-7-15)25(27)28)23-24-20-4-2-3-5-21(20)30-23/h2-14H,1H3/b19-14-InChIKey
IPRIEITZVJIMFM-RGEXLXHISA-NSynonyms
(2E)2(13benzoxazol2yl)1(4methoxyphenyl)3(4nitrophenyl)prop2en1one
(2E)2BENZOXAZOL2YL1(4METHOXYPHENYL)3(4NITROPHENYL)PROP2EN1ONE
(E)2(13BENZOXAZOL2YL)1(4METHOXYPHENYL)3(4NITROPHENYL)PROP2EN1ONE
COC1=CC=C(C=C1)C(=O)C(=CC2=CC=C(C=C2)(N+)(=O)(O))C3=NC4=CC=CC=C4O3
COc1ccc(cc1)C(=O)C(=Cc1ccc(cc1)(N+)(=O)(O))c1nc2c(o1)cccc2
InChI=1SC23H16N2O5c1291812816(91318)22(26)19(141561017(11715)25(27)28)232420423521(20)3023h214H1H3b1914
MFCD03029130
ZINC000005555357
ZINC05555357
ZINC5555357
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