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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15NO7S/c1-11(19-17(21)12-6-2-3-7-13(12)18(19)22)10-16(20)26-14-8-4-5-9-15(14)27(23,24)25/h2-9,11H,10H2,1H3,(H,23,24,25)