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

Systemtic Name: methyl 3-[4-[3-(4-cyanophenyl)-4-methyl-2-oxidanylidene-1H-imidazol-5-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[3-(4-cyanophenyl)-4-methyl-2-oxo-1H-imidazol-5-yl]phenyl]propanoate CAS Name: 3-[4-[3-(4-cyanophenyl)-4-methyl-2-oxo-1H-imidazol-5-yl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-(4-cyanophenyl)-4-methyl-2-oxo-1H-imidazol-5-yl]phenyl]propanoate Traditional Name: 3-[4-[1-(4-cyanophenyl)-2-keto-5-methyl-4-imidazolin-4-yl]phenyl]propionic acid methyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)N1C2=CC=C(C=C2)C#N)C3=CC=C(C=C3)CCC(=O)OC

Isomeric SMILES

CC1=C(NC(=O)N1C2=CC=C(C=C2)C#N)C3=CC=C(C=C3)CCC(=O)OC

InChI

InChI=1S/C21H19N3O3/c1-14-20(17-8-3-15(4-9-17)7-12-19(25)27-2)23-21(26)24(14)18-10-5-16(13-22)6-11-18/h3-6,8-11H,7,12H2,1-2H3,(H,23,26)