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

Systemtic Name: 2,2,3,3-tetrakis(oxidanyl)-5-pyridin-4-ylsulfanyl-naphthalene-1,4-dione Openeye Name: 2,2,3,3-tetrahydroxy-5-(4-pyridylsulfanyl)tetralin-1,4-dione CAS Name: 2,2,3,3-tetrahydroxy-5-(pyridin-4-ylthio)naphthalene-1,4-dione IUPAC Name: 2,2,3,3-tetrahydroxy-5-pyridin-4-ylsulfanylnaphthalene-1,4-dione Traditional Name: 2,2,3,3-tetrahydroxy-5-(4-pyridylthio)tetralin-1,4-quinone Formula: C15H11NO6S MolecularWeight: 333.31594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SC3=CC=NC=C3)C(=O)C(C(C2=O)(O)O)(O)O

Isomeric SMILES

C1=CC2=C(C(=C1)SC3=CC=NC=C3)C(=O)C(C(C2=O)(O)O)(O)O

InChI

InChI=1S/C15H11NO6S/c17-12-9-2-1-3-10(23-8-4-6-16-7-5-8)11(9)13(18)15(21,22)14(12,19)20/h1-7,19-22H