Vitas-M small molecule compound
methyl 6-amino-5-cyano-2-methyl-4-(4-nitrophenyl)-4H-pyran-3-carboxylate
Catalog ID
STK833332
SMILES COC(=O)C1=C(C)OC(=C(C1c1ccc(cc1)[N+](=O)[O-])C#N)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 C15H13N3O5 MW 315.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O5/c1-8-12(15(19)22-2)13(11(7-16)14(17)23-8)9-3-5-10(6-4-9)18(20)21/h3-6,13H,17H2,1-2H3InChIKey
BGYPJIWKYOTJRP-UHFFFAOYSA-NSynonyms
300587-72-8300587728
CC1=C(C(C(=C(O1)N)C#N)C2=CC=C(C=C2)(N+)(=O)(O))C(=O)OC
COC(=O)C1=C(C)OC(=C(C1c1ccc(cc1)(N+)(=O)(O))C#N)N
InChI=1SC15H13N3O5c1812(15(19)222)13(11(716)14(17)238)93510(649)18(20)21h3613H17H212H3
methyl6amino5cyano2methyl4(4nitrophenyl)4Hpyran3carboxylate
MFCD00812110
ZINC000000098041
ZINC000000098043
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Check stock on Vitas-MAvailable files
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