5-(4-oxidanylidene-3,1-benzoxazin-2-yl)-2-[3-(phenylcarbonyl)phenyl]isoindole-1,3-dione

Systemtic Name: 5-(4-oxidanylidene-3,1-benzoxazin-2-yl)-2-[3-(phenylcarbonyl)phenyl]isoindole-1,3-dione Openeye Name: 2-(3-benzoylphenyl)-5-(4-oxo-3,1-benzoxazin-2-yl)isoindoline-1,3-dione CAS Name: 2-(3-benzoylphenyl)-5-(4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione IUPAC Name: 2-(3-benzoylphenyl)-5-(4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione Traditional Name: 2-(3-benzoylphenyl)-5-(4-keto-3,1-benzoxazin-2-yl)isoindoline-1,3-quinone Formula: C29H16N2O5 MolecularWeight: 472.44774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C5=NC6=CC=CC=C6C(=O)O5

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C5=NC6=CC=CC=C6C(=O)O5

InChI

InChI=1S/C29H16N2O5/c32-25(17-7-2-1-3-8-17)18-9-6-10-20(15-18)31-27(33)21-14-13-19(16-23(21)28(31)34)26-30-24-12-5-4-11-22(24)29(35)36-26/h1-16H