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

Systemtic Name: methyl 4-methyl-3-[2-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[2-[[(E)-3-phenylprop-2-enoyl]amino]acetyl]oxyacetyl]amino]benzoate CAS Name: 4-methyl-3-[[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-methyl-3-[[2-[2-[[(E)-3-phenylprop-2-enoyl]amino]acetyl]oxyacetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[2-[[(E)-3-phenylacryloyl]amino]acetyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CNC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CNC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C22H22N2O6/c1-15-8-10-17(22(28)29-2)12-18(15)24-20(26)14-30-21(27)13-23-19(25)11-9-16-6-4-3-5-7-16/h3-12H,13-14H2,1-2H3,(H,23,25)(H,24,26)/b11-9+