benzo[e]isoindole-1,3-dione; 1-methylcyclohexane-1-sulfonic acid

Systemtic Name: benzo[e]isoindole-1,3-dione; 1-methylcyclohexane-1-sulfonic acid Openeye Name: benzo[e]isoindole-1,3-dione; 1-methylcyclohexanesulfonic acid CAS Name: benzo[e]isoindole-1,3-dione; 1-methyl-1-cyclohexanesulfonic acid IUPAC Name: benzo[e]isoindole-1,3-dione; 1-methylcyclohexane-1-sulfonic acid Traditional Name: benz[e]isoindole-1,3-quinone; 1-methylcyclohexanesulfonic acid Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1)S(=O)(=O)O.C1=CC=C2C(=C1)C=CC3=C2C(=O)NC3=O

Isomeric SMILES

CC1(CCCCC1)S(=O)(=O)O.C1=CC=C2C(=C1)C=CC3=C2C(=O)NC3=O

InChI

InChI=1S/C12H7NO2.C7H14O3S/c14-11-9-6-5-7-3-1-2-4-8(7)10(9)12(15)13-11;1-7(11(8,9)10)5-3-2-4-6-7/h1-6H,(H,13,14,15);2-6H2,1H3,(H,8,9,10)