2,3-dimethoxy-5-phenylsulfanyl-naphthalene-1,4-dione

Systemtic Name: 2,3-dimethoxy-5-phenylsulfanyl-naphthalene-1,4-dione Openeye Name: 2,3-dimethoxy-5-phenylsulfanyl-naphthalene-1,4-dione CAS Name: 2,3-dimethoxy-5-(phenylthio)naphthalene-1,4-dione IUPAC Name: 2,3-dimethoxy-5-phenylsulfanylnaphthalene-1,4-dione Traditional Name: 2,3-dimethoxy-5-(phenylthio)-1,4-naphthoquinone Formula: C18H14O4S MolecularWeight: 326.36636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14O4S/c1-21-17-15(19)12-9-6-10-13(14(12)16(20)18(17)22-2)23-11-7-4-3-5-8-11/h3-10H,1-2H3