3-[4-[2-(1-oxidanylideneisoquinolin-2-yl)ethoxy]phenyl]-2-phenoxy-propanamide

Systemtic Name: 3-[4-[2-(1-oxidanylideneisoquinolin-2-yl)ethoxy]phenyl]-2-phenoxy-propanamide Openeye Name: 3-[4-[2-(1-oxo-2-isoquinolyl)ethoxy]phenyl]-2-phenoxy-propanamide CAS Name: 3-[4-[2-(1-oxo-2-isoquinolinyl)ethoxy]phenyl]-2-phenoxypropanamide IUPAC Name: 3-[4-[2-(1-oxoisoquinolin-2-yl)ethoxy]phenyl]-2-phenoxypropanamide Traditional Name: 3-[4-[2-(1-keto-2-isoquinolyl)ethoxy]phenyl]-2-phenoxy-propionamide Formula: C26H24N2O4 MolecularWeight: 428.47976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(CC2=CC=C(C=C2)OCCN3C=CC4=CC=CC=C4C3=O)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)OC(CC2=CC=C(C=C2)OCCN3C=CC4=CC=CC=C4C3=O)C(=O)N

InChI

InChI=1S/C26H24N2O4/c27-25(29)24(32-22-7-2-1-3-8-22)18-19-10-12-21(13-11-19)31-17-16-28-15-14-20-6-4-5-9-23(20)26(28)30/h1-15,24H,16-18H2,(H2,27,29)