2-[[5-chloranyl-2-[(6-phenoxypyridin-3-yl)carbonylamino]phenyl]carbonylamino]-3-phenoxy-propanoic acid

Systemtic Name: 2-[[5-chloranyl-2-[(6-phenoxypyridin-3-yl)carbonylamino]phenyl]carbonylamino]-3-phenoxy-propanoic acid Openeye Name: 2-[[5-chloro-2-[(6-phenoxypyridine-3-carbonyl)amino]benzoyl]amino]-3-phenoxy-propanoic acid CAS Name: 2-[[[5-chloro-2-[[oxo-(6-phenoxy-3-pyridinyl)methyl]amino]phenyl]-oxomethyl]amino]-3-phenoxypropanoic acid IUPAC Name: 2-[[5-chloro-2-[(6-phenoxypyridine-3-carbonyl)amino]benzoyl]amino]-3-phenoxypropanoic acid Traditional Name: 2-[[5-chloro-2-[(6-phenoxynicotinoyl)amino]benzoyl]amino]-3-phenoxy-propionic acid Formula: C28H22ClN3O6 MolecularWeight: 531.94378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(C(=O)O)NC(=O)C2=C(C=CC(=C2)Cl)NC(=O)C3=CN=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OCC(C(=O)O)NC(=O)C2=C(C=CC(=C2)Cl)NC(=O)C3=CN=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C28H22ClN3O6/c29-19-12-13-23(31-26(33)18-11-14-25(30-16-18)38-21-9-5-2-6-10-21)22(15-19)27(34)32-24(28(35)36)17-37-20-7-3-1-4-8-20/h1-16,24H,17H2,(H,31,33)(H,32,34)(H,35,36)