3-[4-[3-[4-(aminomethyl)-2-methyl-phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[3-[4-(aminomethyl)-2-methyl-phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoic acid Openeye Name: 3-[4-[3-[4-(aminomethyl)-2-methyl-phenyl]-2-oxo-imidazolidin-1-yl]phenyl]propanoic acid CAS Name: 3-[4-[3-[4-(aminomethyl)-2-methylphenyl]-2-oxo-1-imidazolidinyl]phenyl]propanoic acid IUPAC Name: 3-[4-[3-[4-(aminomethyl)-2-methylphenyl]-2-oxoimidazolidin-1-yl]phenyl]propanoic acid Traditional Name: 3-[4-[3-[4-(aminomethyl)-2-methyl-phenyl]-2-keto-imidazolidin-1-yl]phenyl]propionic acid Formula: C20H23N3O3 MolecularWeight: 353.41492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CN)N2CCN(C2=O)C3=CC=C(C=C3)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)CN)N2CCN(C2=O)C3=CC=C(C=C3)CCC(=O)O

InChI

InChI=1S/C20H23N3O3/c1-14-12-16(13-21)4-8-18(14)23-11-10-22(20(23)26)17-6-2-15(3-7-17)5-9-19(24)25/h2-4,6-8,12H,5,9-11,13,21H2,1H3,(H,24,25)