2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2,4,6-trimethylbenzenesulfonate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2,4,6-trimethylbenzenesulfonate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2,4,6-trimethylbenzenesulfonate CAS Name: 2,4,6-trimethylbenzenesulfonic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2,4,6-trimethylbenzenesulfonate Traditional Name: 2,4,6-trimethylbenzenesulfonic acid 2-phthalimidoethyl ester Formula: C19H19NO5S MolecularWeight: 373.42286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C19H19NO5S/c1-12-10-13(2)17(14(3)11-12)26(23,24)25-9-8-20-18(21)15-6-4-5-7-16(15)19(20)22/h4-7,10-11H,8-9H2,1-3H3