2-ethyl-1,3-bis(oxidanylidene)benzo[e]isoindole-5-sulfonic acid

Systemtic Name: 2-ethyl-1,3-bis(oxidanylidene)benzo[e]isoindole-5-sulfonic acid Openeye Name: 2-ethyl-1,3-dioxo-benzo[e]isoindole-5-sulfonic acid CAS Name: 2-ethyl-1,3-dioxo-5-benzo[e]isoindolesulfonic acid IUPAC Name: 2-ethyl-1,3-dioxobenzo[e]isoindole-5-sulfonic acid Traditional Name: 2-ethyl-1,3-diketo-benz[e]isoindole-5-sulfonic acid Formula: C14H11NO5S MolecularWeight: 305.30584

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C1=O)C3=CC=CC=C3C(=C2)S(=O)(=O)O

Isomeric SMILES

CCN1C(=O)C2=C(C1=O)C3=CC=CC=C3C(=C2)S(=O)(=O)O

InChI

InChI=1S/C14H11NO5S/c1-2-15-13(16)10-7-11(21(18,19)20)8-5-3-4-6-9(8)12(10)14(15)17/h3-7H,2H2,1H3,(H,18,19,20)