3-[4-[5-[3-(2-azanylethyl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[5-[3-(2-azanylethyl)phenyl]-2-oxidanylidene-imidazolidin-1-yl]phenyl]propanoic acid Openeye Name: 3-[4-[5-[3-(2-aminoethyl)phenyl]-2-oxo-imidazolidin-1-yl]phenyl]propanoic acid CAS Name: 3-[4-[5-[3-(2-aminoethyl)phenyl]-2-oxo-1-imidazolidinyl]phenyl]propanoic acid IUPAC Name: 3-[4-[5-[3-(2-aminoethyl)phenyl]-2-oxoimidazolidin-1-yl]phenyl]propanoic acid Traditional Name: 3-[4-[5-[3-(2-aminoethyl)phenyl]-2-keto-imidazolidin-1-yl]phenyl]propionic acid Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(=O)N1)C2=CC=C(C=C2)CCC(=O)O)C3=CC(=CC=C3)CCN

Isomeric SMILES

C1C(N(C(=O)N1)C2=CC=C(C=C2)CCC(=O)O)C3=CC(=CC=C3)CCN

InChI

InChI=1S/C20H23N3O3/c21-11-10-15-2-1-3-16(12-15)18-13-22-20(26)23(18)17-7-4-14(5-8-17)6-9-19(24)25/h1-5,7-8,12,18H,6,9-11,13,21H2,(H,22,26)(H,24,25)