methyl 4-[2-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoyloxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[2-[[(E)-3-phenylprop-2-enoyl]amino]acetyl]oxyacetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[1-oxo-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]ethoxy]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[2-[[(E)-3-phenylprop-2-enoyl]amino]acetyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[2-[[(E)-3-phenylacryloyl]amino]acetyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CNC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CNC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H20N2O6/c1-28-21(27)16-8-10-17(11-9-16)23-19(25)14-29-20(26)13-22-18(24)12-7-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3,(H,22,24)(H,23,25)/b12-7+