[3-(3-chlorophenyl)phenyl] pentane-1-sulfonate

Systemtic Name: [3-(3-chlorophenyl)phenyl] pentane-1-sulfonate Openeye Name: [3-(3-chlorophenyl)phenyl] pentane-1-sulfonate CAS Name: 1-pentanesulfonic acid IUPAC Name: [3-(3-chlorophenyl)phenyl] pentane-1-sulfonate Traditional Name: pentane-1-sulfonic acid [3-(3-chlorophenyl)phenyl] ester Formula: C17H19ClO3S MolecularWeight: 338.84896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)OC1=CC=CC(=C1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCCS(=O)(=O)OC1=CC=CC(=C1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H19ClO3S/c1-2-3-4-11-22(19,20)21-17-10-6-8-15(13-17)14-7-5-9-16(18)12-14/h5-10,12-13H,2-4,11H2,1H3