1,3-bis(oxidanylidene)-2-[4-(4-phenylquinazolin-2-yl)phenyl]isoindole-5-carboxylic acid

Systemtic Name: 1,3-bis(oxidanylidene)-2-[4-(4-phenylquinazolin-2-yl)phenyl]isoindole-5-carboxylic acid Openeye Name: 1,3-dioxo-2-[4-(4-phenylquinazolin-2-yl)phenyl]isoindoline-5-carboxylic acid CAS Name: 1,3-dioxo-2-[4-(4-phenyl-2-quinazolinyl)phenyl]-5-isoindolecarboxylic acid IUPAC Name: 1,3-dioxo-2-[4-(4-phenylquinazolin-2-yl)phenyl]isoindole-5-carboxylic acid Traditional Name: 1,3-diketo-2-[4-(4-phenylquinazolin-2-yl)phenyl]isoindoline-5-carboxylic acid Formula: C29H17N3O4 MolecularWeight: 471.46298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)N5C(=O)C6=C(C5=O)C=C(C=C6)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)N5C(=O)C6=C(C5=O)C=C(C=C6)C(=O)O

InChI

InChI=1S/C29H17N3O4/c33-27-21-15-12-19(29(35)36)16-23(21)28(34)32(27)20-13-10-18(11-14-20)26-30-24-9-5-4-8-22(24)25(31-26)17-6-2-1-3-7-17/h1-16H,(H,35,36)