methyl 3-[3-[2-acetamido-4-(4-cyanophenyl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]propanoate

Systemtic Name: methyl 3-[3-[2-acetamido-4-(4-cyanophenyl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]propanoate Openeye Name: methyl 3-[3-[2-acetamido-4-(4-cyanophenyl)phenyl]-2-oxo-imidazolidin-1-yl]propanoate CAS Name: 3-[3-[2-acetamido-4-(4-cyanophenyl)phenyl]-2-oxo-1-imidazolidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[2-acetamido-4-(4-cyanophenyl)phenyl]-2-oxoimidazolidin-1-yl]propanoate Traditional Name: 3-[3-[2-acetamido-4-(4-cyanophenyl)phenyl]-2-keto-imidazolidin-1-yl]propionic acid methyl ester Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C2=CC=C(C=C2)C#N)N3CCN(C3=O)CCC(=O)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C2=CC=C(C=C2)C#N)N3CCN(C3=O)CCC(=O)OC

InChI

InChI=1S/C22H22N4O4/c1-15(27)24-19-13-18(17-5-3-16(14-23)4-6-17)7-8-20(19)26-12-11-25(22(26)29)10-9-21(28)30-2/h3-8,13H,9-12H2,1-2H3,(H,24,27)