methyl 3-[4-[5-[4-(1-azanylcyclopropyl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[5-[4-(1-azanylcyclopropyl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[5-[4-(1-aminocyclopropyl)phenyl]-2-oxo-imidazolidin-1-yl]phenyl]propanoate CAS Name: 3-[4-[5-[4-(1-aminocyclopropyl)phenyl]-2-oxo-1-imidazolidinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[5-[4-(1-aminocyclopropyl)phenyl]-2-oxoimidazolidin-1-yl]phenyl]propanoate Traditional Name: 3-[4-[5-[4-(1-aminocyclopropyl)phenyl]-2-keto-imidazolidin-1-yl]phenyl]propionic acid methyl ester Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)N2C(CNC2=O)C3=CC=C(C=C3)C4(CC4)N

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)N2C(CNC2=O)C3=CC=C(C=C3)C4(CC4)N

InChI

InChI=1S/C22H25N3O3/c1-28-20(26)11-4-15-2-9-18(10-3-15)25-19(14-24-21(25)27)16-5-7-17(8-6-16)22(23)12-13-22/h2-3,5-10,19H,4,11-14,23H2,1H3,(H,24,27)