4,5-diphenylbenzene-1,2,3-trisulfonic acid

Systemtic Name: 4,5-diphenylbenzene-1,2,3-trisulfonic acid Openeye Name: 4,5-diphenylbenzene-1,2,3-trisulfonic acid CAS Name: 4,5-diphenylbenzene-1,2,3-trisulfonic acid IUPAC Name: 4,5-diphenylbenzene-1,2,3-trisulfonic acid Traditional Name: 4,5-diphenylbenzene-1,2,3-trisulfonic acid Formula: C18H14O9S3 MolecularWeight: 470.49336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(C(=C2C3=CC=CC=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(C(=C2C3=CC=CC=C3)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C18H14O9S3/c19-28(20,21)15-11-14(12-7-3-1-4-8-12)16(13-9-5-2-6-10-13)18(30(25,26)27)17(15)29(22,23)24/h1-11H,(H,19,20,21)(H,22,23,24)(H,25,26,27)