4-cyclohexa-1,5-dien-1-ylbutane-1-sulfonic acid

Systemtic Name: 4-cyclohexa-1,5-dien-1-ylbutane-1-sulfonic acid Openeye Name: 4-cyclohexa-1,5-dien-1-ylbutane-1-sulfonic acid CAS Name: 4-(1-cyclohexa-1,5-dienyl)-1-butanesulfonic acid IUPAC Name: 4-cyclohexa-1,5-dien-1-ylbutane-1-sulfonic acid Traditional Name: 4-cyclohexa-1,5-dien-1-ylbutane-1-sulfonic acid Formula: C10H16O3S MolecularWeight: 216.29724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C=C1)CCCCS(=O)(=O)O

Isomeric SMILES

C1CC=C(C=C1)CCCCS(=O)(=O)O

InChI

InChI=1S/C10H16O3S/c11-14(12,13)9-5-4-8-10-6-2-1-3-7-10/h2,6-7H,1,3-5,8-9H2,(H,11,12,13)