Vitas-M small molecule compound
2-[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-5-methoxyphenyl 3-nitrobenzoate
Catalog ID
STK841245
SMILES COc1ccc(c(c1)OC(=O)c1cccc(c1)[N+](=O)[O-])C(=O)/C=C/c1ccc(c(c1)OC)OC
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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 C25H21NO8 MW 463.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO8/c1-31-19-9-10-20(21(27)11-7-16-8-12-22(32-2)24(13-16)33-3)23(15-19)34-25(28)17-5-4-6-18(14-17)26(29)30/h4-15H,1-3H3/b11-7+InChIKey
XVANVEUOOMLLHV-YRNVUSSQSA-NSynonyms
433313-04-3(2((E)3(34DIMETHOXYPHENYL)PROP2ENOYL)5METHOXYPHENYL)3NITROBENZOATE
(E)2(3(34dimethoxyphenyl)acryloyl)5methoxyphenyl3nitrobenzoate
2((2E)3(34dimethoxyphenyl)prop2enoyl)5methoxyphenyl3nitrobenzoate
433313043
COC1=CC(=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)OC)OC)OC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
COc1ccc(c(c1)OC(=O)c1cccc(c1)(N+)(=O)(O))C(=O)C=Cc1ccc(c(c1)OC)OC
InChI=1SC25H21NO8c1311991020(21(27)1171681222(322)24(1316)333)23(1519)3425(28)1754618(1417)26(29)30h415H13H3b117+
MFCD03301888
ZINC000009046534
ZINC09046534
ZINC9046534
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