6-(1-oxidanyl-3-oxidanylidene-2-phenethyl-isoindol-1-yl)-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-(1-oxidanyl-3-oxidanylidene-2-phenethyl-isoindol-1-yl)-4H-1,4-benzoxazin-3-one Openeye Name: 6-(1-hydroxy-3-oxo-2-phenethyl-isoindolin-1-yl)-4H-1,4-benzoxazin-3-one CAS Name: 6-(1-hydroxy-3-oxo-2-phenethyl-1-isoindolyl)-4H-1,4-benzoxazin-3-one IUPAC Name: 6-(1-hydroxy-3-oxo-2-phenethylisoindol-1-yl)-4H-1,4-benzoxazin-3-one Traditional Name: 6-(1-hydroxy-3-keto-2-phenethyl-isoindolin-1-yl)-4H-1,4-benzoxazin-3-one Formula: C24H20N2O4 MolecularWeight: 400.4266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)C3(C4=CC=CC=C4C(=O)N3CCC5=CC=CC=C5)O

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)C3(C4=CC=CC=C4C(=O)N3CCC5=CC=CC=C5)O

InChI

InChI=1S/C24H20N2O4/c27-22-15-30-21-11-10-17(14-20(21)25-22)24(29)19-9-5-4-8-18(19)23(28)26(24)13-12-16-6-2-1-3-7-16/h1-11,14,29H,12-13,15H2,(H,25,27)