4-[2-[(4-chlorophenyl)methyl]-1,3-bis(oxidanylidene)isoindol-5-yl]sulfonylbenzoate

Systemtic Name: 4-[2-[(4-chlorophenyl)methyl]-1,3-bis(oxidanylidene)isoindol-5-yl]sulfonylbenzoate Openeye Name: 4-[2-[(4-chlorophenyl)methyl]-1,3-dioxo-isoindolin-5-yl]sulfonylbenzoate CAS Name: 4-[[2-[(4-chlorophenyl)methyl]-1,3-dioxo-5-isoindolyl]sulfonyl]benzoate IUPAC Name: 4-[2-[(4-chlorophenyl)methyl]-1,3-dioxoisoindol-5-yl]sulfonylbenzoate Traditional Name: 4-[2-(4-chlorobenzyl)-1,3-diketo-isoindolin-5-yl]sulfonylbenzoate Formula: C22H13ClNO6S- MolecularWeight: 454.85972

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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-])Cl

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-])Cl

InChI

InChI=1S/C22H14ClNO6S/c23-15-5-1-13(2-6-15)12-24-20(25)18-10-9-17(11-19(18)21(24)26)31(29,30)16-7-3-14(4-8-16)22(27)28/h1-11H,12H2,(H,27,28)/p-1