Vitas-M small molecule compound
butyl (2E)-3-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-2-cyanoprop-2-enoate
Catalog ID
STK949438
SMILES CCCCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1Cl)[N+](=O)[O-])/C#N
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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 C18H15ClN2O5 MW 374.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN2O5/c1-2-3-8-25-18(22)12(11-20)9-14-5-7-17(26-14)15-6-4-13(21(23)24)10-16(15)19/h4-7,9-10H,2-3,8H2,1H3/b12-9+InChIKey
ZONOYCFPRFNCFE-FMIVXFBMSA-NSynonyms
BUTYL(2E)3(5(2CHLORO4NITROPHENYL)(2FURYL))2CYANOPROP2ENOATE
butyl(2E)3(5(2chloro4nitrophenyl)furan2yl)2cyanoprop2enoate
BUTYL(E)3(5(2CHLORO4NITROPHENYL)FURAN2YL)2CYANOPROP2ENOATE
CCCCOC(=O)C(=CC1=CC=C(O1)C2=C(C=C(C=C2)(N+)(=O)(O))Cl)C#N
CCCCOC(=O)C(=Cc1ccc(o1)c1ccc(cc1Cl)(N+)(=O)(O))C#N
InChI=1SC18H15ClN2O5c12382518(22)12(1120)9145717(2614)156413(21(23)24)1016(15)19h47910H238H21H3b129+
MFCD02371087
ZINC000001805826
ZINC01805826
ZINC1805826
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