3-phenylcyclohexa-2,4-diene-1-sulfonic acid

Systemtic Name: 3-phenylcyclohexa-2,4-diene-1-sulfonic acid Openeye Name: 3-phenylcyclohexa-2,4-diene-1-sulfonic acid CAS Name: 3-phenyl-1-cyclohexa-2,4-dienesulfonic acid IUPAC Name: 3-phenylcyclohexa-2,4-diene-1-sulfonic acid Traditional Name: 3-phenylcyclohexa-2,4-diene-1-sulfonic acid Formula: C12H12O3S MolecularWeight: 236.28688

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(=CC1S(=O)(=O)O)C2=CC=CC=C2

Isomeric SMILES

C1C=CC(=CC1S(=O)(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C12H12O3S/c13-16(14,15)12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-7,9,12H,8H2,(H,13,14,15)