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

Systemtic Name: methyl 3-[4-[3-[4-(methylaminomethyl)phenyl]-2-oxidanylidene-imidazolidin-4-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[3-[4-(methylaminomethyl)phenyl]-2-oxo-imidazolidin-4-yl]phenyl]propanoate CAS Name: 3-[4-[3-[4-(methylaminomethyl)phenyl]-2-oxo-4-imidazolidinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[3-[4-(methylaminomethyl)phenyl]-2-oxoimidazolidin-4-yl]phenyl]propanoate Traditional Name: 3-[4-[2-keto-3-[4-(methylaminomethyl)phenyl]imidazolidin-4-yl]phenyl]propionic acid methyl ester Formula: C21H25N3O3 MolecularWeight: 367.4415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC=C(C=C1)N2C(CNC2=O)C3=CC=C(C=C3)CCC(=O)OC

Isomeric SMILES

CNCC1=CC=C(C=C1)N2C(CNC2=O)C3=CC=C(C=C3)CCC(=O)OC

InChI

InChI=1S/C21H25N3O3/c1-22-13-16-5-10-18(11-6-16)24-19(14-23-21(24)26)17-8-3-15(4-9-17)7-12-20(25)27-2/h3-6,8-11,19,22H,7,12-14H2,1-2H3,(H,23,26)