methyl 3-[3-chloranyl-4-[3-(4-cyanophenyl)-2-oxidanylidene-imidazolidin-4-yl]phenyl]propanoate

Systemtic Name: methyl 3-[3-chloranyl-4-[3-(4-cyanophenyl)-2-oxidanylidene-imidazolidin-4-yl]phenyl]propanoate Openeye Name: methyl 3-[3-chloro-4-[3-(4-cyanophenyl)-2-oxo-imidazolidin-4-yl]phenyl]propanoate CAS Name: 3-[3-chloro-4-[3-(4-cyanophenyl)-2-oxo-4-imidazolidinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-chloro-4-[3-(4-cyanophenyl)-2-oxoimidazolidin-4-yl]phenyl]propanoate Traditional Name: 3-[3-chloro-4-[3-(4-cyanophenyl)-2-keto-imidazolidin-4-yl]phenyl]propionic acid methyl ester Formula: C20H18ClN3O3 MolecularWeight: 383.82822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC(=C(C=C1)C2CNC(=O)N2C3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

COC(=O)CCC1=CC(=C(C=C1)C2CNC(=O)N2C3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C20H18ClN3O3/c1-27-19(25)9-5-13-4-8-16(17(21)10-13)18-12-23-20(26)24(18)15-6-2-14(11-22)3-7-15/h2-4,6-8,10,18H,5,9,12H2,1H3,(H,23,26)