Vitas-M small molecule compound
4-{(E)-[3-(4-chlorophenyl)-5-oxo-1,2-oxazol-4(5H)-ylidene]methyl}phenyl 4-nitrobenzoate
Catalog ID
STL427094
SMILES Clc1ccc(cc1)C1=NOC(=O)/C/1=C/c1ccc(cc1)OC(=O)c1ccc(cc1)[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 C23H13ClN2O6 MW 448.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13ClN2O6/c24-17-7-3-15(4-8-17)21-20(23(28)32-25-21)13-14-1-11-19(12-2-14)31-22(27)16-5-9-18(10-6-16)26(29)30/h1-13H/b20-13+InChIKey
DUJNXQCHXZYQLM-DEDYPNTBSA-NSynonyms
(4((E)(3(4CHLOROPHENYL)5OXO12OXAZOL4YLIDENE)METHYL)PHENYL)4NITROBENZOATE
4((E)(3(4chlorophenyl)5oxo12oxazol4(5H)ylidene)methyl)phenyl4nitrobenzoate
C1=CC(=CC=C1C=C2C(=NOC2=O)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
Clc1ccc(cc1)C1=NOC(=O)C1=Cc1ccc(cc1)OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC23H13ClN2O6c24177315(4817)2120(23(28)322521)131411119(12214)3122(27)165918(10616)26(29)30h113Hb2013+
MFCD01190127
ZINC000002076661
ZINC2076661
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