Vitas-M small molecule compound
2-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK677402
SMILES CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)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 C20H21N3O6 MW 399.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O6/c1-4-28-14-6-10(5-12(18(14)25)23(26)27)16-11(9-21)19(22)29-15-8-20(2,3)7-13(24)17(15)16/h5-6,16,25H,4,7-8,22H2,1-3H3InChIKey
NWQDNQOXIZHQAQ-UHFFFAOYSA-NSynonyms
2AMINO4(3ETHOXY4HYDROXY5NITROPHENYL)5KETO77DIMETHYL68DIHYDRO4HCHROMENE3CARBONITRILE
2amino4(3ethoxy4hydroxy5nitrophenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO4(3ETHOXY4HYDROXY5NITROPHENYL)77DIMETHYL5OXO68DIHYDRO4H1BENZOPYRAN3CARBONITRILE
2AMINO4(3ETHOXY4HYDROXY5NITROPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
2AMINO4(5ETHOXY4HYDROXY3NITROPHENYL)77DIMETHYL5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
2AZANYL4(3ETHOXY5NITRO4OXIDANYLPHENYL)77DIMETHYL5OXIDANYLIDENE68DIHYDRO4HCHROMENE3CARBONITRILE
CCOC1=CC(=CC(=C1O)(N+)(=O)(O))C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N
CCOc1cc(cc(c1O)(N+)(=O)(O))C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C#N
InChI=1SC20H21N3O6c142814610(512(18(14)25)23(26)27)1611(921)19(22)2915820(23)713(24)17(15)16h561625H47822H213H3
MFCD01788247
ZINC000036031932
ZINC000036031935
Check stock
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