2-cyclohexa-1,3-dien-1-ylbenzenesulfonic acid

Systemtic Name: 2-cyclohexa-1,3-dien-1-ylbenzenesulfonic acid Openeye Name: 2-cyclohexa-1,3-dien-1-ylbenzenesulfonic acid CAS Name: 2-(1-cyclohexa-1,3-dienyl)benzenesulfonic acid IUPAC Name: 2-cyclohexa-1,3-dien-1-ylbenzenesulfonic acid Traditional Name: 2-cyclohexa-1,3-dien-1-ylbesylic acid Formula: C12H12O3S MolecularWeight: 236.28688

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC=C1)C2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

C1CC(=CC=C1)C2=CC=CC=C2S(=O)(=O)O

InChI

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