Vitas-M small molecule compound
2-[1-(3,4-dimethoxyphenyl)-2-nitroethyl]-2-phenyl-1H-indene-1,3(2H)-dione
Catalog ID
STL325381
SMILES COc1cc(ccc1OC)C(C1(c2ccccc2)C(=O)c2c(C1=O)cccc2)C[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 C25H21NO6 MW 431.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO6/c1-31-21-13-12-16(14-22(21)32-2)20(15-26(29)30)25(17-8-4-3-5-9-17)23(27)18-10-6-7-11-19(18)24(25)28/h3-14,20H,15H2,1-2H3InChIKey
ZLUBCJZABUFRFM-UHFFFAOYSA-NSynonyms
342396-43-42(1(34dimethoxyphenyl)2nitroethyl)2phenyl1Hindene13(2H)dione
2(1(34DIMETHOXYPHENYL)2NITROETHYL)2PHENYLINDENE13DIONE
342396434
COC1=C(C=C(C=C1)C(C(N+)(=O)(O))C2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4)OC
COc1cc(ccc1OC)C(C1(c2ccccc2)C(=O)c2c(C1=O)cccc2)C(N+)(=O)(O)
InChI=1SC25H21NO6c13121131216(1422(21)322)20(1526(29)30)25(178435917)23(27)1810671119(18)24(25)28h31420H15H212H3
MFCD01179301
ZINC000000727439
ZINC000000727440
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