Vitas-M small molecule compound
methyl 4-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]benzoate
Catalog ID
STK298487
SMILES COC(=O)c1ccc(cc1)Cn1cnc(n1)[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 C11H10N4O4 MW 262.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10N4O4/c1-19-10(16)9-4-2-8(3-5-9)6-14-7-12-11(13-14)15(17)18/h2-5,7H,6H2,1H3InChIKey
YFZZBOUDQHUOON-UHFFFAOYSA-NSynonyms
406470-74-44(3NITRO(124)TRIAZOL1YLMETHYL)BENZOICACIDMETHYLESTER
406470744
COC(=O)C1=CC=C(C=C1)CN2C=NC(=N2)(N+)(=O)(O)
COC(=O)c1ccc(cc1)Cn1cnc(n1)(N+)(=O)(O)
InChI=1SC11H10N4O4c11910(16)9428(359)61471211(1314)15(17)18h257H6H21H3
METHYL4((3NITRO124TRIAZOL1YL)METHYL)BENZOATE
METHYL4((3NITRO124TRIAZOLYL)METHYL)BENZOATE
METHYL4((3NITRO1H124TRIAZOL1YL)METHYL)BENZOATE
MFCD03303115
ZINC000000551949
ZINC00551949
ZINC551949
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