2-(4-chlorophenyl)sulfanyl-8-oxidanyl-naphthalene-1,4-dione

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-8-oxidanyl-naphthalene-1,4-dione Openeye Name: 2-(4-chlorophenyl)sulfanyl-8-hydroxy-naphthalene-1,4-dione CAS Name: 2-[(4-chlorophenyl)thio]-8-hydroxynaphthalene-1,4-dione IUPAC Name: 2-(4-chlorophenyl)sulfanyl-8-hydroxynaphthalene-1,4-dione Traditional Name: 2-[(4-chlorophenyl)thio]-8-hydroxy-1,4-naphthoquinone Formula: C16H9ClO3S MolecularWeight: 316.75886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)O)C(=O)C(=CC2=O)SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)O)C(=O)C(=CC2=O)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H9ClO3S/c17-9-4-6-10(7-5-9)21-14-8-13(19)11-2-1-3-12(18)15(11)16(14)20/h1-8,18H