2,2,3,3-tetrakis(oxidanyl)-5-phenylsulfanyl-naphthalene-1,4-dione

Systemtic Name: 2,2,3,3-tetrakis(oxidanyl)-5-phenylsulfanyl-naphthalene-1,4-dione Openeye Name: 2,2,3,3-tetrahydroxy-5-phenylsulfanyl-tetralin-1,4-dione CAS Name: 2,2,3,3-tetrahydroxy-5-(phenylthio)naphthalene-1,4-dione IUPAC Name: 2,2,3,3-tetrahydroxy-5-phenylsulfanylnaphthalene-1,4-dione Traditional Name: 2,2,3,3-tetrahydroxy-5-(phenylthio)tetralin-1,4-quinone Formula: C16H12O6S MolecularWeight: 332.32788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC3=C2C(=O)C(C(C3=O)(O)O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC3=C2C(=O)C(C(C3=O)(O)O)(O)O

InChI

InChI=1S/C16H12O6S/c17-13-10-7-4-8-11(23-9-5-2-1-3-6-9)12(10)14(18)16(21,22)15(13,19)20/h1-8,19-22H