Vitas-M small molecule compound

butan-2-yl (2E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoate

Catalog ID
STK949468
SMILES CCC(OC(=O)/C(=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/C#N)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/c1-3-12(2)24-18(21)14(11-19)10-16-7-8-17(25-16)13-5-4-6-15(9-13)20(22)23/h4-10,12H,3H2,1-2H3/b14-10+
InChIKey
GVNHVFKXHFNMPQ-GXDHUFHOSA-N
Synonyms
301339-44-6
2CYANO3(5(3NITROPHENYL)FURAN2YL)ACRYLICACIDSECBUTYLESTER
301339446
butan2yl(2E)2cyano3(5(3nitrophenyl)furan2yl)prop2enoate
BUTAN2YL(E)2CYANO3(5(3NITROPHENYL)FURAN2YL)PROP2ENOATE
CCC(C)OC(=O)C(=CC1=CC=C(O1)C2=CC(=CC=C2)(N+)(=O)(O))C#N
CCC(OC(=O)C(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))C#N)C
InChI=1SC18H16N2O5c1312(2)2418(21)14(1119)10167817(2516)1354615(913)20(22)23h41012H3H212H3b1410+
METHYLPROPYL(2E)2CYANO3(5(3NITROPHENYL)(2FURYL))PROP2ENOATE
MFCD01918483
ZINC000002669698
ZINC000002669700

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Available files

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