3-[5-carbamimidoyl-2-[4-(phenylcarbonyl)phenyl]phenyl]propanoic acid

Systemtic Name: 3-[5-carbamimidoyl-2-[4-(phenylcarbonyl)phenyl]phenyl]propanoic acid Openeye Name: 3-[2-(4-benzoylphenyl)-5-carbamimidoyl-phenyl]propanoic acid CAS Name: 3-[2-(4-benzoylphenyl)-5-carbamimidoylphenyl]propanoic acid IUPAC Name: 3-[2-(4-benzoylphenyl)-5-carbamimidoylphenyl]propanoic acid Traditional Name: 3-[5-amidino-2-(4-benzoylphenyl)phenyl]propionic acid Formula: C23H20N2O3 MolecularWeight: 372.4165

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O3/c24-23(25)19-10-12-20(18(14-19)11-13-21(26)27)15-6-8-17(9-7-15)22(28)16-4-2-1-3-5-16/h1-10,12,14H,11,13H2,(H3,24,25)(H,26,27)