3-phenyldodecane-1-sulfonate

Systemtic Name: 3-phenyldodecane-1-sulfonate Openeye Name: 3-phenyldodecane-1-sulfonate CAS Name: 3-phenyl-1-dodecanesulfonate IUPAC Name: 3-phenyldodecane-1-sulfonate Traditional Name: 3-phenyldodecane-1-sulfonate Formula: C18H29O3S- MolecularWeight: 325.48606

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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)/p-1