Vitas-M small molecule compound
2-(3-hydroxy-4-methoxyphenyl)-5-(3-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK062377
SMILES COc1ccc(cc1O)N1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)[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 C21H14N2O7 MW 406.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N2O7/c1-29-19-8-5-12(10-18(19)24)22-20(25)16-7-6-15(11-17(16)21(22)26)30-14-4-2-3-13(9-14)23(27)28/h2-11,24H,1H3InChIKey
UCFIACXBWZXCSA-UHFFFAOYSA-NSynonyms
2(3HYDROXY4METHOXYPHENYL)5(3NITROPHENOXY)1HISOINDOLE13(2H)DIONE
2(3HYDROXY4METHOXYPHENYL)5(3NITROPHENOXY)ISOINDOLE13DIONE
COC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)(N+)(=O)(O))O
COc1ccc(cc1O)N1C(=O)c2c(C1=O)cc(cc2)Oc1cccc(c1)(N+)(=O)(O)
InChI=1SC21H14N2O7c129198512(1018(19)24)2220(25)167615(1117(16)21(22)26)301442313(914)23(27)28h21124H1H3
MFCD01137096
STK062377
ZINC000001207927
ZINC01207927
ZINC1207927
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