5-isoquinolin-4-yl-2-oxidanylidene-N-(3-phenoxyphenyl)-1H-pyridine-3-carboxamide

Systemtic Name: 5-isoquinolin-4-yl-2-oxidanylidene-N-(3-phenoxyphenyl)-1H-pyridine-3-carboxamide Openeye Name: 5-(4-isoquinolyl)-2-oxo-N-(3-phenoxyphenyl)-1H-pyridine-3-carboxamide CAS Name: 5-(4-isoquinolinyl)-2-oxo-N-(3-phenoxyphenyl)-1H-pyridine-3-carboxamide IUPAC Name: 5-isoquinolin-4-yl-2-oxo-N-(3-phenoxyphenyl)-1H-pyridine-3-carboxamide Traditional Name: 5-(4-isoquinolyl)-2-keto-N-(3-phenoxyphenyl)-1H-pyridine-3-carboxamide Formula: C27H19N3O3 MolecularWeight: 433.45806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)NC(=O)C3=CC(=CNC3=O)C4=CN=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)NC(=O)C3=CC(=CNC3=O)C4=CN=CC5=CC=CC=C54

InChI

InChI=1S/C27H19N3O3/c31-26-24(13-19(16-29-26)25-17-28-15-18-7-4-5-12-23(18)25)27(32)30-20-8-6-11-22(14-20)33-21-9-2-1-3-10-21/h1-17H,(H,29,31)(H,30,32)