Vitas-M small molecule compound
(2E)-N-(3-chloro-2-methylphenyl)-3-(2-nitrophenyl)prop-2-enamide
Catalog ID
STK107633
SMILES O=C(Nc1cccc(c1C)Cl)/C=C/c1ccccc1[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 C16H13ClN2O3 MW 316.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN2O3/c1-11-13(17)6-4-7-14(11)18-16(20)10-9-12-5-2-3-8-15(12)19(21)22/h2-10H,1H3,(H,18,20)/b10-9+InChIKey
MYWKENBPBXRQAD-MDZDMXLPSA-NSynonyms
587846-25-1(2E)N(3CHLORO2METHYLPHENYL)3(2NITROPHENYL)PROP2ENAMIDE
(E)N(3CHLORO2METHYLPHENYL)3(2NITROPHENYL)PROP2ENAMIDE
587846251
CC1=C(C=CC=C1Cl)NC(=O)C=CC2=CC=CC=C2(N+)(=O)(O)
InChI=1SC16H13ClN2O3c11113(17)64714(11)1816(20)10912523815(12)19(21)22h210H1H3(H1820)b109+
MFCD03638971
O=C(Nc1cccc(c1C)Cl)C=Cc1ccccc1(N+)(=O)(O)
ZINC000000465263
ZINC00465263
ZINC465263
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