Vitas-M small molecule compound
5-(5-nitro-1,3-benzoxazol-2-yl)-2-phenyl-1H-isoindole-1,3(2H)-dione
Catalog ID
STK021746
SMILES O=C1c2cc(ccc2C(=O)N1c1ccccc1)c1nc2c(o1)ccc(c2)[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 C21H11N3O5 MW 385.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H11N3O5/c25-20-15-8-6-12(10-16(15)21(26)23(20)13-4-2-1-3-5-13)19-22-17-11-14(24(27)28)7-9-18(17)29-19/h1-11HInChIKey
HOPUKDKRJXVIEI-UHFFFAOYSA-NSynonyms
5(5NITRO13BENZOXAZOL2YL)2PHENYL1HISOINDOLE13(2H)DIONE
5(5NITRO13BENZOXAZOL2YL)2PHENYLISOINDOLE13DIONE
C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(O4)C=CC(=C5)(N+)(=O)(O)
InChI=1SC21H11N3O5c2520158612(1016(15)21(26)23(20)134213513)1922171114(24(27)28)7918(17)2919h111H
MFCD01003919
O=C1c2cc(ccc2C(=O)N1c1ccccc1)c1nc2c(o1)ccc(c2)(N+)(=O)(O)
STK021746
ZINC000004590748
ZINC04590748
ZINC4590748
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