Vitas-M small molecule compound
(2E)-N-(4-butylphenyl)-3-(4-chloro-3-nitrophenyl)prop-2-enamide
Catalog ID
STL377440
SMILES CCCCc1ccc(cc1)NC(=O)/C=C/c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C19H19ClN2O3 MW 358.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O3/c1-2-3-4-14-5-9-16(10-6-14)21-19(23)12-8-15-7-11-17(20)18(13-15)22(24)25/h5-13H,2-4H2,1H3,(H,21,23)/b12-8+InChIKey
XCPOUCSDOBCSLV-XYOKQWHBSA-NSynonyms
(2E)N(4butylphenyl)3(4chloro3nitrophenyl)prop2enamide
(E)N(4BUTYLPHENYL)3(4CHLORO3NITROPHENYL)PROP2ENAMIDE
CCCCC1=CC=C(C=C1)NC(=O)C=CC2=CC(=C(C=C2)Cl)(N+)(=O)(O)
CCCCc1ccc(cc1)NC(=O)C=Cc1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC19H19ClN2O3c1234145916(10614)2119(23)1281571117(20)18(1315)22(24)25h513H24H21H3(H2123)b128+
MFCD03060822
ZINC000002984518
ZINC02984518
ZINC2984518
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