Vitas-M small molecule compound
2-{benzyl[2-nitro-4-(trifluoromethyl)phenyl]amino}ethyl benzoate
Catalog ID
STK773680
SMILES [O-][N+](=O)c1cc(ccc1N(Cc1ccccc1)CCOC(=O)c1ccccc1)C(F)(F)F
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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 C23H19F3N2O4 MW 444.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19F3N2O4/c24-23(25,26)19-11-12-20(21(15-19)28(30)31)27(16-17-7-3-1-4-8-17)13-14-32-22(29)18-9-5-2-6-10-18/h1-12,15H,13-14,16H2InChIKey
SDNPETXCBDVCKD-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc(ccc1N(Cc1ccccc1)CCOC(=O)c1ccccc1)C(F)(F)F
2(benzyl(2nitro4(trifluoromethyl)phenyl)amino)ethylbenzoate
2(NBENZYL2NITRO4(TRIFLUOROMETHYL)ANILINO)ETHYLBENZOATE
C1=CC=C(C=C1)CN(CCOC(=O)C2=CC=CC=C2)C3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O)
InChI=1SC23H19F3N2O4c2423(2526)19111220(21(1519)28(30)31)27(16177314817)13143222(29)1895261018h11215H131416H2
MFCD03855284
ZINC000008892438
ZINC08892438
ZINC8892438
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