2-[1,3-bis(oxidanylidene)benzo[e]isoindol-2-yl]oxysulfonyl-5-tert-butyl-benzoic acid

Systemtic Name: 2-[1,3-bis(oxidanylidene)benzo[e]isoindol-2-yl]oxysulfonyl-5-tert-butyl-benzoic acid Openeye Name: 5-tert-butyl-2-(1,3-dioxobenzo[e]isoindol-2-yl)oxysulfonyl-benzoic acid CAS Name: 5-tert-butyl-2-[(1,3-dioxo-2-benzo[e]isoindolyl)oxysulfonyl]benzoic acid IUPAC Name: 5-tert-butyl-2-(1,3-dioxobenzo[e]isoindol-2-yl)oxysulfonylbenzoic acid Traditional Name: 5-tert-butyl-2-(1,3-diketobenz[e]isoindol-2-yl)oxysulfonyl-benzoic acid Formula: C23H19NO7S MolecularWeight: 453.46446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)S(=O)(=O)ON2C(=O)C3=C(C2=O)C4=CC=CC=C4C=C3)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)S(=O)(=O)ON2C(=O)C3=C(C2=O)C4=CC=CC=C4C=C3)C(=O)O

InChI

InChI=1S/C23H19NO7S/c1-23(2,3)14-9-11-18(17(12-14)22(27)28)32(29,30)31-24-20(25)16-10-8-13-6-4-5-7-15(13)19(16)21(24)26/h4-12H,1-3H3,(H,27,28)