Vitas-M small molecule compound
2-amino-7,7-dimethyl-4-(2-nitrophenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK059269
SMILES N#CC1=C(N)OC2=C(C1c1ccccc1[N+](=O)[O-])C(=O)CC(C2)(C)C
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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 C18H17N3O4 MW 339.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O4/c1-18(2)7-13(22)16-14(8-18)25-17(20)11(9-19)15(16)10-5-3-4-6-12(10)21(23)24/h3-6,15H,7-8,20H2,1-2H3InChIKey
BAVLYSBNEQORIY-UHFFFAOYSA-NSynonyms
315245-01-3(S)2amino77dimethyl4(2nitrophenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO77DIMETHYL4(2NITROPHENYL)5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
2amino77dimethyl4(2nitrophenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO77DIMETHYL4(2NITROPHENYL)5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
315245013
CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC=CC=C3(N+)(=O)(O))C(=O)C1)C
InChI=1SC18H17N3O4c118(2)713(22)1614(818)2517(20)11(919)15(16)10534612(10)21(23)24h3615H7820H212H3
MFCD00486627
N#CC1=C(N)OC2=C((C@H)1c1ccccc1(N+)(=O)(O))C(=O)CC(C2)(C)C
N#CC1=C(N)OC2=C(C1c1ccccc1(N+)(=O)(O))C(=O)CC(C2)(C)C
STK059269
ZINC000000330089
ZINC000004427240
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