3-phenyl-3-[5-(quinolin-2-ylcarbonylamino)benzimidazol-1-yl]propanoic acid

Systemtic Name: 3-phenyl-3-[5-(quinolin-2-ylcarbonylamino)benzimidazol-1-yl]propanoic acid Openeye Name: 3-phenyl-3-[5-(quinoline-2-carbonylamino)benzimidazol-1-yl]propanoic acid CAS Name: 3-[5-[[oxo(2-quinolinyl)methyl]amino]-1-benzimidazolyl]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-3-[5-(quinoline-2-carbonylamino)benzimidazol-1-yl]propanoic acid Traditional Name: 3-phenyl-3-[5-(quinaldoylamino)benzimidazol-1-yl]propionic acid Formula: C26H20N4O3 MolecularWeight: 436.462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)N2C=NC3=C2C=CC(=C3)NC(=O)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)N2C=NC3=C2C=CC(=C3)NC(=O)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H20N4O3/c31-25(32)15-24(18-7-2-1-3-8-18)30-16-27-22-14-19(11-13-23(22)30)28-26(33)21-12-10-17-6-4-5-9-20(17)29-21/h1-14,16,24H,15H2,(H,28,33)(H,31,32)