2-[4-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]isoindole-1,3-dione Openeye Name: 2-[4-(4-oxo-3,1-benzoxazin-2-yl)phenyl]isoindoline-1,3-dione CAS Name: 2-[4-(4-oxo-3,1-benzoxazin-2-yl)phenyl]isoindole-1,3-dione IUPAC Name: 2-[4-(4-oxo-3,1-benzoxazin-2-yl)phenyl]isoindole-1,3-dione Traditional Name: 2-[4-(4-keto-3,1-benzoxazin-2-yl)phenyl]isoindoline-1,3-quinone Formula: C22H12N2O4 MolecularWeight: 368.34168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)C4=NC5=CC=CC=C5C(=O)O4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=C(C=C3)C4=NC5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C22H12N2O4/c25-20-15-5-1-2-6-16(15)21(26)24(20)14-11-9-13(10-12-14)19-23-18-8-4-3-7-17(18)22(27)28-19/h1-12H