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

Systemtic Name: 3-[4-[3-[4-(1-azanyl-2-methyl-propyl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoic acid Openeye Name: 3-[4-[3-[4-(1-amino-2-methyl-propyl)phenyl]-2-oxo-imidazolidin-1-yl]phenyl]propanoic acid CAS Name: 3-[4-[3-[4-(1-amino-2-methylpropyl)phenyl]-2-oxo-1-imidazolidinyl]phenyl]propanoic acid IUPAC Name: 3-[4-[3-[4-(1-amino-2-methylpropyl)phenyl]-2-oxoimidazolidin-1-yl]phenyl]propanoic acid Traditional Name: 3-[4-[3-[4-(1-amino-2-methyl-propyl)phenyl]-2-keto-imidazolidin-1-yl]phenyl]propionic acid Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)N2CCN(C2=O)C3=CC=C(C=C3)CCC(=O)O)N

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)N2CCN(C2=O)C3=CC=C(C=C3)CCC(=O)O)N

InChI

InChI=1S/C22H27N3O3/c1-15(2)21(23)17-6-10-19(11-7-17)25-14-13-24(22(25)28)18-8-3-16(4-9-18)5-12-20(26)27/h3-4,6-11,15,21H,5,12-14,23H2,1-2H3,(H,26,27)