Vitas-M small molecule compound

(2E)-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-3-phenylprop-2-enamide

Catalog ID
STK367413
SMILES O=C(Nc1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])/C=C/c1ccccc1

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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 C16H10F3N3O5 MW 381.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10F3N3O5/c17-16(18,19)11-8-12(21(24)25)15(13(9-11)22(26)27)20-14(23)7-6-10-4-2-1-3-5-10/h1-9H,(H,20,23)/b7-6+
InChIKey
YCODFPWWFXCCIR-VOTSOKGWSA-N
Synonyms

(2E)N(26dinitro4(trifluoromethyl)phenyl)3phenylprop2enamide
(E)N(26DINITRO4(TRIFLUOROMETHYL)PHENYL)3PHENYLPROP2ENAMIDE
C1=CC=C(C=C1)C=CC(=O)NC2=C(C=C(C=C2(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
InChI=1SC16H10F3N3O5c1716(1819)11812(21(24)25)15(13(911)22(26)27)2014(23)76104213510h19H(H2023)b76+
MFCD00358714
O=C(Nc1c(cc(cc1(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O))C=Cc1ccccc1
ZINC000004016109
ZINC04016109
ZINC4016109

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Available files

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