2-(4-methylphenyl)sulfanyl-5-oxidanyl-naphthalene-1,4-dione

Systemtic Name: 2-(4-methylphenyl)sulfanyl-5-oxidanyl-naphthalene-1,4-dione Openeye Name: 5-hydroxy-2-(p-tolylsulfanyl)naphthalene-1,4-dione CAS Name: 5-hydroxy-2-[(4-methylphenyl)thio]naphthalene-1,4-dione IUPAC Name: 5-hydroxy-2-(4-methylphenyl)sulfanylnaphthalene-1,4-dione Traditional Name: 5-hydroxy-2-(p-tolylthio)-1,4-naphthoquinone Formula: C17H12O3S MolecularWeight: 296.34038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC(=O)C3=C(C2=O)C=CC=C3O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC(=O)C3=C(C2=O)C=CC=C3O

InChI

InChI=1S/C17H12O3S/c1-10-5-7-11(8-6-10)21-15-9-14(19)16-12(17(15)20)3-2-4-13(16)18/h2-9,18H,1H3