isoindole-1,3-dione; 1-methylcyclohexane-1-sulfonic acid

Systemtic Name: isoindole-1,3-dione; 1-methylcyclohexane-1-sulfonic acid Openeye Name: isoindoline-1,3-dione; 1-methylcyclohexanesulfonic acid CAS Name: isoindole-1,3-dione; 1-methyl-1-cyclohexanesulfonic acid IUPAC Name: isoindole-1,3-dione; 1-methylcyclohexane-1-sulfonic acid Traditional Name: 1-methylcyclohexanesulfonic acid; phthalimide Formula: C15H19NO5S MolecularWeight: 325.38006

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1)S(=O)(=O)O.C1=CC=C2C(=C1)C(=O)NC2=O

Isomeric SMILES

CC1(CCCCC1)S(=O)(=O)O.C1=CC=C2C(=C1)C(=O)NC2=O

InChI

InChI=1S/C8H5NO2.C7H14O3S/c10-7-5-3-1-2-4-6(5)8(11)9-7;1-7(11(8,9)10)5-3-2-4-6-7/h1-4H,(H,9,10,11);2-6H2,1H3,(H,8,9,10)