[2-[[1,3-bis(oxidanylidene)isoindol-2-yl]amino]-2-oxidanylidene-ethyl] 4-methylbenzenesulfonate

Systemtic Name: [2-[[1,3-bis(oxidanylidene)isoindol-2-yl]amino]-2-oxidanylidene-ethyl] 4-methylbenzenesulfonate Openeye Name: [2-[(1,3-dioxoisoindolin-2-yl)amino]-2-oxo-ethyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-[(1,3-dioxo-2-isoindolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1,3-dioxoisoindol-2-yl)amino]-2-oxoethyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-keto-2-(phthalimidoamino)ethyl] ester Formula: C17H14N2O6S MolecularWeight: 374.36786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)NN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)NN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C17H14N2O6S/c1-11-6-8-12(9-7-11)26(23,24)25-10-15(20)18-19-16(21)13-4-2-3-5-14(13)17(19)22/h2-9H,10H2,1H3,(H,18,20)