3-[1-[3-(2,4-dichlorophenyl)-3-oxidanylidene-2-phenyl-propyl]imidazol-4-yl]propanoic acid

Systemtic Name: 3-[1-[3-(2,4-dichlorophenyl)-3-oxidanylidene-2-phenyl-propyl]imidazol-4-yl]propanoic acid Openeye Name: 3-[1-[3-(2,4-dichlorophenyl)-3-oxo-2-phenyl-propyl]imidazol-4-yl]propanoic acid CAS Name: 3-[1-[3-(2,4-dichlorophenyl)-3-oxo-2-phenylpropyl]-4-imidazolyl]propanoic acid IUPAC Name: 3-[1-[3-(2,4-dichlorophenyl)-3-oxo-2-phenylpropyl]imidazol-4-yl]propanoic acid Traditional Name: 3-[1-[3-(2,4-dichlorophenyl)-3-keto-2-phenyl-propyl]imidazol-4-yl]propionic acid Formula: C21H18Cl2N2O3 MolecularWeight: 417.28522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CN2C=C(N=C2)CCC(=O)O)C(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CN2C=C(N=C2)CCC(=O)O)C(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H18Cl2N2O3/c22-15-6-8-17(19(23)10-15)21(28)18(14-4-2-1-3-5-14)12-25-11-16(24-13-25)7-9-20(26)27/h1-6,8,10-11,13,18H,7,9,12H2,(H,26,27)