ethyl 4-[[(E)-3-(1-benzofuran-2-yl)-2-cyano-prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 4-[[(E)-3-(1-benzofuran-2-yl)-2-cyano-prop-2-enoyl]amino]benzoate Openeye Name: ethyl 4-[[(E)-3-(benzofuran-2-yl)-2-cyano-prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(2-benzofuranyl)-2-cyano-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(1-benzofuran-2-yl)-2-cyanoprop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(benzofuran-2-yl)-2-cyano-acryloyl]amino]benzoic acid ethyl ester Formula: C21H16N2O4 MolecularWeight: 360.36274

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CC3=CC=CC=C3O2)C#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)/C(=C/C2=CC3=CC=CC=C3O2)/C#N

InChI

InChI=1S/C21H16N2O4/c1-2-26-21(25)14-7-9-17(10-8-14)23-20(24)16(13-22)12-18-11-15-5-3-4-6-19(15)27-18/h3-12H,2H2,1H3,(H,23,24)/b16-12+