1,1-bis(2,3-dihydro-1H-indol-5-yl)-3-oxidanylidene-2-benzofuran-4-carboxylic acid

Systemtic Name: 1,1-bis(2,3-dihydro-1H-indol-5-yl)-3-oxidanylidene-2-benzofuran-4-carboxylic acid Openeye Name: 1,1-di(indolin-5-yl)-3-oxo-isobenzofuran-4-carboxylic acid CAS Name: 1,1-bis(2,3-dihydro-1H-indol-5-yl)-3-oxo-4-isobenzofurancarboxylic acid IUPAC Name: 1,1-bis(2,3-dihydro-1H-indol-5-yl)-3-oxo-2-benzofuran-4-carboxylic acid Traditional Name: 1,1-di(indolin-5-yl)-3-keto-phthalan-4-carboxylic acid Formula: C25H20N2O4 MolecularWeight: 412.4373

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=C1C=C(C=C2)C3(C4=CC=CC(=C4C(=O)O3)C(=O)O)C5=CC6=C(C=C5)NCC6

Isomeric SMILES

C1CNC2=C1C=C(C=C2)C3(C4=CC=CC(=C4C(=O)O3)C(=O)O)C5=CC6=C(C=C5)NCC6

InChI

InChI=1S/C25H20N2O4/c28-23(29)18-2-1-3-19-22(18)24(30)31-25(19,16-4-6-20-14(12-16)8-10-26-20)17-5-7-21-15(13-17)9-11-27-21/h1-7,12-13,26-27H,8-11H2,(H,28,29)