4-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]benzenesulfonate

Systemtic Name: 4-[(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]benzenesulfonate Openeye Name: 4-[(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]benzenesulfonate CAS Name: 4-[(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]benzenesulfonate IUPAC Name: 4-[(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]benzenesulfonate Traditional Name: 4-[(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]besylate Formula: C13H10NO5S- MolecularWeight: 292.2872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC=C2C=CC(=O)C=C2O)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC=C2C=CC(=O)C=C2O)S(=O)(=O)[O-]

InChI

InChI=1S/C13H11NO5S/c15-11-4-1-9(13(16)7-11)8-14-10-2-5-12(6-3-10)20(17,18)19/h1-8,14,16H,(H,17,18,19)/p-1