Vitas-M small molecule compound
2-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-7-(furan-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK677513
SMILES CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)OC2=C1C(=O)CC(C2)c1ccco1)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 C22H19N3O7 MW 437.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O7/c1-2-30-18-9-12(6-14(21(18)27)25(28)29)19-13(10-23)22(24)32-17-8-11(7-15(26)20(17)19)16-4-3-5-31-16/h3-6,9,11,19,27H,2,7-8,24H2,1H3InChIKey
NZFANHAAMXWBCM-UHFFFAOYSA-NSynonyms
2amino4(3ethoxy4hydroxy5nitrophenyl)7(furan2yl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(3ethoxy4hydroxy5nitrophenyl)7(furan2yl)5oxo5678tetrahydro4Hchromene3carbonitrile
CCOC1=CC(=CC(=C1O)(N+)(=O)(O))C2C(=C(OC3=C2C(=O)CC(C3)C4=CC=CO4)N)C#N
CCOc1cc(cc(c1O)(N+)(=O)(O))C1C(=C(N)OC2=C1C(=O)CC(C2)c1ccco1)C#N
InChI=1SC22H19N3O7c123018912(614(21(18)27)25(28)29)1913(1023)22(24)3217811(715(26)20(17)19)164353116h369111927H27824H21H3
MFCD03035506
ZINC000036031964
ZINC000036031973
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