2-methoxy-5-phenylsulfanyl-naphthalene-1,4-dione

Systemtic Name: 2-methoxy-5-phenylsulfanyl-naphthalene-1,4-dione Openeye Name: 2-methoxy-5-phenylsulfanyl-naphthalene-1,4-dione CAS Name: 2-methoxy-5-(phenylthio)naphthalene-1,4-dione IUPAC Name: 2-methoxy-5-phenylsulfanylnaphthalene-1,4-dione Traditional Name: 2-methoxy-5-(phenylthio)-1,4-naphthoquinone Formula: C17H12O3S MolecularWeight: 296.34038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C2=C(C1=O)C=CC=C2SC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=O)C2=C(C1=O)C=CC=C2SC3=CC=CC=C3

InChI

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