4-methylbenzenesulfonic acid; 1-oxidanyl-2-[[(E)-(5-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]guanidine

Systemtic Name: 4-methylbenzenesulfonic acid; 1-oxidanyl-2-[[(E)-(5-oxidanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]guanidine Openeye Name: 1-hydroxy-2-[[(E)-(5-hydroxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]guanidine; 4-methylbenzenesulfonic acid CAS Name: 1-hydroxy-2-[[(E)-(5-hydroxy-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]guanidine; 4-methylbenzenesulfonic acid IUPAC Name: 1-hydroxy-2-[[(E)-(5-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]guanidine; 4-methylbenzenesulfonic acid Traditional Name: 1-hydroxy-2-[[(E)-(5-hydroxy-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]guanidine; tosylic acid Formula: C15H18N4O6S MolecularWeight: 382.39162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=CNN=C(N)NO)C(=O)C(=C1)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1=C/C(=C\N/N=C(/N)\NO)/C(=O)C(=C1)O

InChI

InChI=1S/C8H10N4O3.C7H8O3S/c9-8(12-15)11-10-4-5-2-1-3-6(13)7(5)14;1-6-2-4-7(5-3-6)11(8,9)10/h1-4,10,13,15H,(H3,9,11,12);2-5H,1H3,(H,8,9,10)/b5-4+;