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

Systemtic Name: 5-(4-nitrophenyl)sulfanyl-2,2,3,3-tetrakis(oxidanyl)naphthalene-1,4-dione Openeye Name: 2,2,3,3-tetrahydroxy-5-(4-nitrophenyl)sulfanyl-tetralin-1,4-dione CAS Name: 2,2,3,3-tetrahydroxy-5-[(4-nitrophenyl)thio]naphthalene-1,4-dione IUPAC Name: 2,2,3,3-tetrahydroxy-5-(4-nitrophenyl)sulfanylnaphthalene-1,4-dione Traditional Name: 2,2,3,3-tetrahydroxy-5-[(4-nitrophenyl)thio]tetralin-1,4-quinone Formula: C16H11NO8S MolecularWeight: 377.32544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SC3=CC=C(C=C3)[N+](=O)[O-])C(=O)C(C(C2=O)(O)O)(O)O

Isomeric SMILES

C1=CC2=C(C(=C1)SC3=CC=C(C=C3)[N+](=O)[O-])C(=O)C(C(C2=O)(O)O)(O)O

InChI

InChI=1S/C16H11NO8S/c18-13-10-2-1-3-11(12(10)14(19)16(22,23)15(13,20)21)26-9-6-4-8(5-7-9)17(24)25/h1-7,20-23H