[6-(aziridin-1-yl)-5,8-bis(oxidanylidene)naphthalen-1-yl] quinoline-8-sulfonate

Systemtic Name: [6-(aziridin-1-yl)-5,8-bis(oxidanylidene)naphthalen-1-yl] quinoline-8-sulfonate Openeye Name: [6-(aziridin-1-yl)-5,8-dioxo-1-naphthyl] quinoline-8-sulfonate CAS Name: 8-quinolinesulfonic acid [6-(1-aziridinyl)-5,8-dioxo-1-naphthalenyl] ester IUPAC Name: [6-(aziridin-1-yl)-5,8-dioxonaphthalen-1-yl] quinoline-8-sulfonate Traditional Name: quinoline-8-sulfonic acid (6-ethylenimino-5,8-diketo-1-naphthyl) ester Formula: C21H14N2O5S MolecularWeight: 406.41126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1C2=CC(=O)C3=C(C2=O)C=CC=C3OS(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1CN1C2=CC(=O)C3=C(C2=O)C=CC=C3OS(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C21H14N2O5S/c24-16-12-15(23-10-11-23)21(25)14-6-2-7-17(19(14)16)28-29(26,27)18-8-1-4-13-5-3-9-22-20(13)18/h1-9,12H,10-11H2