Vitas-M small molecule compound
3-acetyl-1,2-dimethyl-1H-indol-5-yl 4-nitrobenzoate
Catalog ID
STK869833
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])Oc1ccc2c(c1)c(C(=O)C)c(n2C)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 C19H16N2O5 MW 352.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O5/c1-11-18(12(2)22)16-10-15(8-9-17(16)20(11)3)26-19(23)13-4-6-14(7-5-13)21(24)25/h4-10H,1-3H3InChIKey
VRWKNSJDJXLRBY-UHFFFAOYSA-NSynonyms
342396-77-4(3ACETYL12DIMETHYLINDOL5YL)4NITROBENZOATE
342396774
3acetyl12dimethyl1Hindol5yl4nitrobenzoate
CC1=C(C2=C(N1C)C=CC(=C2)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O))C(=O)C
InChI=1SC19H16N2O5c11118(12(2)22)161015(8917(16)20(11)3)2619(23)134614(7513)21(24)25h410H13H3
MFCD01238581
O=C(c1ccc(cc1)(N+)(=O)(O))Oc1ccc2c(c1)c(C(=O)C)c(n2C)C
ZINC000000727453
ZINC00727453
ZINC727453
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