3-butylazulene-1-sulfonic acid

Systemtic Name: 3-butylazulene-1-sulfonic acid Openeye Name: 3-butylazulene-1-sulfonic acid CAS Name: 3-butyl-1-azulenesulfonic acid IUPAC Name: 3-butylazulene-1-sulfonic acid Traditional Name: 3-butylazulene-1-sulfonic acid Formula: C14H16O3S MolecularWeight: 264.34004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C2C1=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

CCCCC1=CC(=C2C1=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C14H16O3S/c1-2-3-7-11-10-14(18(15,16)17)13-9-6-4-5-8-12(11)13/h4-6,8-10H,2-3,7H2,1H3,(H,15,16,17)