4-[[5-(4-carboxylatophenyl)sulfonyl-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]benzoate

Systemtic Name: 4-[[5-(4-carboxylatophenyl)sulfonyl-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]benzoate Openeye Name: 4-[[5-(4-carboxylatophenyl)sulfonyl-1,3-dioxo-isoindolin-2-yl]methyl]benzoate CAS Name: 4-[[5-(4-carboxylatophenyl)sulfonyl-1,3-dioxo-2-isoindolyl]methyl]benzoate IUPAC Name: 4-[[5-(4-carboxylatophenyl)sulfonyl-1,3-dioxoisoindol-2-yl]methyl]benzoate Traditional Name: 4-[[5-(4-carboxylatophenyl)sulfonyl-1,3-diketo-isoindolin-2-yl]methyl]benzoate Formula: C23H13NO8S-2 MolecularWeight: 463.41622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CN2C(=O)C3=C(C2=O)C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C23H15NO8S/c25-20-18-10-9-17(33(31,32)16-7-5-15(6-8-16)23(29)30)11-19(18)21(26)24(20)12-13-1-3-14(4-2-13)22(27)28/h1-11H,12H2,(H,27,28)(H,29,30)/p-2