Vitas-M small molecule compound
2-methylpropyl (2E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoate
Catalog ID
STK949476
SMILES N#C/C(=C\c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/C(=O)OCC(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 C18H16N2O5 MW 340.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O5/c1-12(2)11-24-18(21)14(10-19)9-16-6-7-17(25-16)13-4-3-5-15(8-13)20(22)23/h3-9,12H,11H2,1-2H3/b14-9+InChIKey
NBGJJUUQBBSMAO-NTEUORMPSA-NSynonyms
301339-30-02METHYLPROPYL(2E)2CYANO3(5(3NITROPHENYL)(2FURYL))PROP2ENOATE
2methylpropyl(2E)2cyano3(5(3nitrophenyl)furan2yl)prop2enoate
2METHYLPROPYL(E)2CYANO3(5(3NITROPHENYL)FURAN2YL)PROP2ENOATE
301339300
CC(C)COC(=O)C(=CC1=CC=C(O1)C2=CC(=CC=C2)(N+)(=O)(O))C#N
InChI=1SC18H16N2O5c112(2)112418(21)14(1019)9166717(2516)1343515(813)20(22)23h3912H11H212H3b149+
MFCD01918471
N#CC(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))C(=O)OCC(C)C
ZINC000002669726
ZINC02669726
ZINC2669726
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