2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoyloxy]benzenesulfonic acid

Systemtic Name: 2-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoyloxy]benzenesulfonic acid Openeye Name: 2-[2-(1,3-dioxoisoindolin-2-yl)butanoyloxy]benzenesulfonic acid CAS Name: 2-[2-(1,3-dioxo-2-isoindolyl)-1-oxobutoxy]benzenesulfonic acid IUPAC Name: 2-[2-(1,3-dioxoisoindol-2-yl)butanoyloxy]benzenesulfonic acid Traditional Name: 2-(2-phthalimidobutanoyloxy)besylic acid Formula: C18H15NO7S MolecularWeight: 389.3792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1=CC=CC=C1S(=O)(=O)O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC(C(=O)OC1=CC=CC=C1S(=O)(=O)O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H15NO7S/c1-2-13(19-16(20)11-7-3-4-8-12(11)17(19)21)18(22)26-14-9-5-6-10-15(14)27(23,24)25/h3-10,13H,2H2,1H3,(H,23,24,25)