3-phenyldodecane-1-sulfonic acid

Systemtic Name: 3-phenyldodecane-1-sulfonic acid Openeye Name: 3-phenyldodecane-1-sulfonic acid CAS Name: 3-phenyl-1-dodecanesulfonic acid IUPAC Name: 3-phenyldodecane-1-sulfonic acid Traditional Name: 3-phenyldodecane-1-sulfonic acid Formula: C18H30O3S MolecularWeight: 326.494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCS(=O)(=O)O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCC(CCS(=O)(=O)O)C1=CC=CC=C1

InChI

InChI=1S/C18H30O3S/c1-2-3-4-5-6-7-9-14-18(15-16-22(19,20)21)17-12-10-8-11-13-17/h8,10-13,18H,2-7,9,14-16H2,1H3,(H,19,20,21)