3-azanylcyclohexa-1,3-diene-1-sulfonic acid

Systemtic Name: 3-azanylcyclohexa-1,3-diene-1-sulfonic acid Openeye Name: 3-aminocyclohexa-1,3-diene-1-sulfonic acid CAS Name: 3-amino-1-cyclohexa-1,3-dienesulfonic acid IUPAC Name: 3-aminocyclohexa-1,3-diene-1-sulfonic acid Traditional Name: 3-aminocyclohexa-1,3-diene-1-sulfonic acid Formula: C6H9NO3S MolecularWeight: 175.20556

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=C1)N)S(=O)(=O)O

Isomeric SMILES

C1CC(=CC(=C1)N)S(=O)(=O)O

InChI

InChI=1S/C6H9NO3S/c7-5-2-1-3-6(4-5)11(8,9)10/h2,4H,1,3,7H2,(H,8,9,10)