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

Systemtic Name: methyl 4-methyl-3-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[[(E)-3-phenylprop-2-enoyl]amino]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[[(E)-3-phenylprop-2-enoyl]amino]acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[[(E)-3-phenylacryloyl]amino]acetyl]amino]benzoic acid methyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O4/c1-14-8-10-16(20(25)26-2)12-17(14)22-19(24)13-21-18(23)11-9-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3,(H,21,23)(H,22,24)/b11-9+