methyl 3-[4-[3-(4-cyanophenyl)-2-oxidanylidene-1H-imidazol-5-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[3-(4-cyanophenyl)-2-oxidanylidene-1H-imidazol-5-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[3-(4-cyanophenyl)-2-oxo-1H-imidazol-5-yl]phenyl]propanoate CAS Name: 3-[4-[3-(4-cyanophenyl)-2-oxo-1H-imidazol-5-yl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(4-cyanophenyl)-2-oxo-1H-imidazol-5-yl]phenyl]propanoate Traditional Name: 3-[4-[1-(4-cyanophenyl)-2-keto-4-imidazolin-4-yl]phenyl]propionic acid methyl ester Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)C2=CN(C(=O)N2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)C2=CN(C(=O)N2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H17N3O3/c1-26-19(24)11-6-14-2-7-16(8-3-14)18-13-23(20(25)22-18)17-9-4-15(12-21)5-10-17/h2-5,7-10,13H,6,11H2,1H3,(H,22,25)