[3-[2,3-bis(chloranyl)phenyl]phenyl] pentane-1-sulfonate

Systemtic Name: [3-[2,3-bis(chloranyl)phenyl]phenyl] pentane-1-sulfonate Openeye Name: [3-(2,3-dichlorophenyl)phenyl] pentane-1-sulfonate CAS Name: 1-pentanesulfonic acid IUPAC Name: [3-(2,3-dichlorophenyl)phenyl] pentane-1-sulfonate Traditional Name: pentane-1-sulfonic acid [3-(2,3-dichlorophenyl)phenyl] ester Formula: C17H18Cl2O3S MolecularWeight: 373.29402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18Cl2O3S/c1-2-3-4-11-23(20,21)22-14-8-5-7-13(12-14)15-9-6-10-16(18)17(15)19/h5-10,12H,2-4,11H2,1H3