Vitas-M small molecule compound
ethyl 3-(4-methoxyphenyl)-3-{[(6-nitro-2-oxo-2H-chromen-3-yl)carbonyl]amino}propanoate
Catalog ID
STK770599
SMILES CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)c1cc2cc(ccc2oc1=O)[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 C22H20N2O8 MW 440.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O8/c1-3-31-20(25)12-18(13-4-7-16(30-2)8-5-13)23-21(26)17-11-14-10-15(24(28)29)6-9-19(14)32-22(17)27/h4-11,18H,3,12H2,1-2H3,(H,23,26)InChIKey
VTRIRDIDYSZUHV-UHFFFAOYSA-NSynonyms
CCOC(=O)CC(C1=CC=C(C=C1)OC)NC(=O)C2=CC3=C(C=CC(=C3)(N+)(=O)(O))OC2=O
CCOC(=O)CC(c1ccc(cc1)OC)NC(=O)c1cc2cc(ccc2oc1=O)(N+)(=O)(O)
ethyl3(4methoxyphenyl)3(((6nitro2oxo2Hchromen3yl)carbonyl)amino)propanoate
ETHYL3(4METHOXYPHENYL)3((6NITRO2OXOCHROMENE3CARBONYL)AMINO)PROPANOATE
InChI=1SC22H20N2O8c133120(25)1218(134716(302)8513)2321(26)1711141015(24(28)29)6919(14)3222(17)27h41118H312H212H3(H2326)
MFCD03766370
ZINC000003623167
ZINC000003623169
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