2-oxidanyl-5-[[(10-oxidanylideneacridin-10-ium-9-ylidene)methylamino]sulfamoyl]benzoic acid

Systemtic Name: 2-oxidanyl-5-[[(10-oxidanylideneacridin-10-ium-9-ylidene)methylamino]sulfamoyl]benzoic acid Openeye Name: 2-hydroxy-5-[[(10-oxoacridin-10-ium-9-ylidene)methylamino]sulfamoyl]benzoic acid CAS Name: 2-hydroxy-5-[[(10-oxo-9-acridin-10-iumylidene)methylamino]sulfamoyl]benzoic acid IUPAC Name: 2-hydroxy-5-[[(10-oxoacridin-10-ium-9-ylidene)methylamino]sulfamoyl]benzoic acid Traditional Name: 2-hydroxy-5-[[(10-ketoacridin-10-ium-9-ylidene)methylamino]sulfamoyl]benzoic acid Formula: C21H16N3O6S+ MolecularWeight: 438.43324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNNS(=O)(=O)C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4[N+]2=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CNNS(=O)(=O)C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4[N+]2=O

InChI

InChI=1S/C21H15N3O6S/c25-20-10-9-13(11-16(20)21(26)27)31(29,30)23-22-12-17-14-5-1-3-7-18(14)24(28)19-8-4-2-6-15(17)19/h1-12,23H,(H2-,22,25,26,27,28)/p+1