methyl 3-[4-[(5-cyano-1-benzofuran-2-yl)carbonylamino]phenyl]propanoate

Systemtic Name: methyl 3-[4-[(5-cyano-1-benzofuran-2-yl)carbonylamino]phenyl]propanoate Openeye Name: methyl 3-[4-[(5-cyanobenzofuran-2-carbonyl)amino]phenyl]propanoate CAS Name: 3-[4-[[(5-cyano-2-benzofuranyl)-oxomethyl]amino]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[(5-cyano-1-benzofuran-2-carbonyl)amino]phenyl]propanoate Traditional Name: 3-[4-[(5-cyanobenzofuran-2-carbonyl)amino]phenyl]propionic acid methyl ester Formula: C20H16N2O4 MolecularWeight: 348.35204

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)NC(=O)C2=CC3=C(O2)C=CC(=C3)C#N

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)NC(=O)C2=CC3=C(O2)C=CC(=C3)C#N

InChI

InChI=1S/C20H16N2O4/c1-25-19(23)9-5-13-2-6-16(7-3-13)22-20(24)18-11-15-10-14(12-21)4-8-17(15)26-18/h2-4,6-8,10-11H,5,9H2,1H3,(H,22,24)