3,5-diethylcyclohexa-1,5-diene-1-sulfonic acid

Systemtic Name: 3,5-diethylcyclohexa-1,5-diene-1-sulfonic acid Openeye Name: 3,5-diethylcyclohexa-1,5-diene-1-sulfonic acid CAS Name: 3,5-diethyl-1-cyclohexa-1,5-dienesulfonic acid IUPAC Name: 3,5-diethylcyclohexa-1,5-diene-1-sulfonic acid Traditional Name: 3,5-diethylcyclohexa-1,5-diene-1-sulfonic acid Formula: C10H16O3S MolecularWeight: 216.29724

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(=CC(=C1)S(=O)(=O)O)CC

Isomeric SMILES

CCC1CC(=CC(=C1)S(=O)(=O)O)CC

InChI

InChI=1S/C10H16O3S/c1-3-8-5-9(4-2)7-10(6-8)14(11,12)13/h6-8H,3-5H2,1-2H3,(H,11,12,13)