[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl] propane-1-sulfonate

Systemtic Name: [1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl] propane-1-sulfonate Openeye Name: (1,3-dioxobenzo[de]isoquinolin-2-yl) propane-1-sulfonate CAS Name: 1-propanesulfonic acid IUPAC Name: (1,3-dioxobenzo[de]isoquinolin-2-yl) propane-1-sulfonate Traditional Name: propane-1-sulfonic acid (1,3-diketobenzo[de]isoquinolin-2-yl) ester Formula: C15H13NO5S MolecularWeight: 319.33242

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)ON1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O

Isomeric SMILES

CCCS(=O)(=O)ON1C(=O)C2=CC=CC3=C2C(=CC=C3)C1=O

InChI

InChI=1S/C15H13NO5S/c1-2-9-22(19,20)21-16-14(17)11-7-3-5-10-6-4-8-12(13(10)11)15(16)18/h3-8H,2,9H2,1H3