2-(4-methylphenyl)sulfanyl-5,8-bis(oxidanyl)naphthalene-1,4-dione

Systemtic Name: 2-(4-methylphenyl)sulfanyl-5,8-bis(oxidanyl)naphthalene-1,4-dione Openeye Name: 5,8-dihydroxy-2-(p-tolylsulfanyl)naphthalene-1,4-dione CAS Name: 5,8-dihydroxy-2-[(4-methylphenyl)thio]naphthalene-1,4-dione IUPAC Name: 5,8-dihydroxy-2-(4-methylphenyl)sulfanylnaphthalene-1,4-dione Traditional Name: 5,8-dihydroxy-2-(p-tolylthio)-1,4-naphthoquinone Formula: C17H12O4S MolecularWeight: 312.33978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC(=O)C3=C(C=CC(=C3C2=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC(=O)C3=C(C=CC(=C3C2=O)O)O

InChI

InChI=1S/C17H12O4S/c1-9-2-4-10(5-3-9)22-14-8-13(20)15-11(18)6-7-12(19)16(15)17(14)21/h2-8,18-19H,1H3