3-[4-[4-(4-carbamimidoylphenyl)-2-oxidanylidene-3-phenyl-imidazol-1-yl]phenyl]propanoic acid

Systemtic Name: 3-[4-[4-(4-carbamimidoylphenyl)-2-oxidanylidene-3-phenyl-imidazol-1-yl]phenyl]propanoic acid Openeye Name: 3-[4-[4-(4-carbamimidoylphenyl)-2-oxo-3-phenyl-imidazol-1-yl]phenyl]propanoic acid CAS Name: 3-[4-[4-(4-carbamimidoylphenyl)-2-oxo-3-phenyl-1-imidazolyl]phenyl]propanoic acid IUPAC Name: 3-[4-[4-(4-carbamimidoylphenyl)-2-oxo-3-phenylimidazol-1-yl]phenyl]propanoic acid Traditional Name: 3-[4-[4-(4-amidinophenyl)-2-keto-3-phenyl-4-imidazolin-1-yl]phenyl]propionic acid Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CN(C2=O)C3=CC=C(C=C3)CCC(=O)O)C4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CN(C2=O)C3=CC=C(C=C3)CCC(=O)O)C4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C25H22N4O3/c26-24(27)19-11-9-18(10-12-19)22-16-28(25(32)29(22)21-4-2-1-3-5-21)20-13-6-17(7-14-20)8-15-23(30)31/h1-7,9-14,16H,8,15H2,(H3,26,27)(H,30,31)