Vitas-M small molecule compound
2-tert-butyl-5-(3-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
Catalog ID
STK299836
SMILES O=C1c2cc(ccc2C(=O)N1C(C)(C)C)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 C18H16N2O5 MW 340.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O5/c1-18(2,3)19-16(21)14-8-7-13(10-15(14)17(19)22)25-12-6-4-5-11(9-12)20(23)24/h4-10H,1-3H3InChIKey
OWCDJFGVFHQAQX-UHFFFAOYSA-NSynonyms
774184-10-02tertbutyl5(3nitrophenoxy)1Hisoindole13(2H)dione
2TERTBUTYL5(3NITROPHENOXY)ISOINDOLE13DIONE
774184100
CC(C)(C)N1C(=O)C2=C(C1=O)C=C(C=C2)OC3=CC=CC(=C3)(N+)(=O)(O)
InChI=1SC18H16N2O5c118(23)1916(21)148713(1015(14)17(19)22)251264511(912)20(23)24h410H13H3
MFCD01974803
O=C1c2cc(ccc2C(=O)N1C(C)(C)C)Oc1cccc(c1)(N+)(=O)(O)
ZINC000000303449
ZINC00303449
ZINC303449
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