Vitas-M small molecule compound
(2Z)-2-(4-chlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3-nitrobenzoate
Catalog ID
STK593717
SMILES Clc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)c1cccc(c1)[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 C22H12ClNO6 MW 421.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H12ClNO6/c23-15-6-4-13(5-7-15)10-20-21(25)18-9-8-17(12-19(18)30-20)29-22(26)14-2-1-3-16(11-14)24(27)28/h1-12H/b20-10-InChIKey
ZTEGLKOYOHPQOI-JMIUGGIZSA-NSynonyms
892621-82-8((2Z)2((4CHLOROPHENYL)METHYLIDENE)3OXO1BENZOFURAN6YL)3NITROBENZOATE
(2Z)2(4chlorobenzylidene)3oxo23dihydro1benzofuran6yl3nitrobenzoate
(Z)2(4chlorobenzylidene)3oxo23dihydrobenzofuran6yl3nitrobenzoate
2((4CHLOROPHENYL)METHYLENE)3OXOBENZO(34B)FURAN6YL3NITROBENZOATE
892621828
C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=C(C=C4)Cl)O3
Clc1ccc(cc1)C=C1Oc2c(C1=O)ccc(c2)OC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC22H12ClNO6c23156413(5715)102021(25)189817(1219(18)3020)2922(26)1421316(1114)24(27)28h112Hb2010
MFCD06783792
ZINC000009215782
ZINC09215782
ZINC9215782
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