3-propylazulene-1-sulfonic acid

Systemtic Name: 3-propylazulene-1-sulfonic acid Openeye Name: 3-propylazulene-1-sulfonic acid CAS Name: 3-propyl-1-azulenesulfonic acid IUPAC Name: 3-propylazulene-1-sulfonic acid Traditional Name: 3-propylazulene-1-sulfonic acid Formula: C13H14O3S MolecularWeight: 250.31346

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C2C1=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

CCCC1=CC(=C2C1=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C13H14O3S/c1-2-6-10-9-13(17(14,15)16)12-8-5-3-4-7-11(10)12/h3-5,7-9H,2,6H2,1H3,(H,14,15,16)