3-phenyl-2-[[2-(pyridin-4-ylcarbonylamino)phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-phenyl-2-[[2-(pyridin-4-ylcarbonylamino)phenyl]carbonylamino]propanoic acid Openeye Name: 3-phenyl-2-[[2-(pyridine-4-carbonylamino)benzoyl]amino]propanoic acid CAS Name: 2-[[oxo-[2-[[oxo(pyridin-4-yl)methyl]amino]phenyl]methyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-2-[[2-(pyridine-4-carbonylamino)benzoyl]amino]propanoic acid Traditional Name: 2-[(2-isonicotinamidobenzoyl)amino]-3-phenyl-propionic acid Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=CC=CC=C2NC(=O)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)C2=CC=CC=C2NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C22H19N3O4/c26-20(16-10-12-23-13-11-16)24-18-9-5-4-8-17(18)21(27)25-19(22(28)29)14-15-6-2-1-3-7-15/h1-13,19H,14H2,(H,24,26)(H,25,27)(H,28,29)