benzenesulfonic acid; phenylsulfonylbenzene

Systemtic Name: benzenesulfonic acid; phenylsulfonylbenzene Openeye Name: benzenesulfonic acid; benzenesulfonylbenzene CAS Name: benzenesulfonic acid; benzenesulfonylbenzene IUPAC Name: benzenesulfonic acid; benzenesulfonylbenzene Traditional Name: besylbenzene; besylic acid Formula: C24H22O8S3 MolecularWeight: 534.62168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2.C1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2.C1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C12H10O2S.2C6H6O3S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12;2*7-10(8,9)6-4-2-1-3-5-6/h1-10H;2*1-5H,(H,7,8,9)