Vitas-M small molecule compound
2-[(2E)-3-(4-nitrophenyl)prop-2-enoyl]-1H-indene-1,3(2H)-dione
Catalog ID
STK324576
SMILES O=C(C1C(=O)c2c(C1=O)cccc2)/C=C/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 C18H11NO5 MW 321.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11NO5/c20-15(10-7-11-5-8-12(9-6-11)19(23)24)16-17(21)13-3-1-2-4-14(13)18(16)22/h1-10,16H/b10-7+InChIKey
XXWMYIFSPWDPCD-JXMROGBWSA-NSynonyms
2((2E)3(4NITROPHENYL)PROP2ENOYL)1HINDENE13(2H)DIONE
2((E)3(4NITROPHENYL)PROP2ENOYL)INDENE13DIONE
2(4NITROTRANSCINNAMOYL)INDAN13DIONE
C1=CC=C2C(=C1)C(=O)C(C2=O)C(=O)C=CC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC18H11NO5c2015(107115812(9611)19(23)24)1617(21)13312414(13)18(16)22h11016Hb107+
MFCD00389640
O=C(C1C(=O)c2c(C1=O)cccc2)C=Cc1ccc(cc1)(N+)(=O)(O)
ZINC000100326903
ZINC100326903
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