2,6-bis[(4-ethoxyphenyl)sulfanyl]-5,8-bis(oxidanyl)naphthalene-1,4-dione

Systemtic Name: 2,6-bis[(4-ethoxyphenyl)sulfanyl]-5,8-bis(oxidanyl)naphthalene-1,4-dione Openeye Name: 2,6-bis[(4-ethoxyphenyl)sulfanyl]-5,8-dihydroxy-naphthalene-1,4-dione CAS Name: 2,6-bis[(4-ethoxyphenyl)thio]-5,8-dihydroxynaphthalene-1,4-dione IUPAC Name: 2,6-bis[(4-ethoxyphenyl)sulfanyl]-5,8-dihydroxynaphthalene-1,4-dione Traditional Name: 5,8-dihydroxy-2,6-bis(p-phenetylthio)-1,4-naphthoquinone Formula: C26H22O6S2 MolecularWeight: 494.57928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)SC2=CC(=O)C3=C(C2=O)C(=CC(=C3O)SC4=CC=C(C=C4)OCC)O

Isomeric SMILES

CCOC1=CC=C(C=C1)SC2=CC(=O)C3=C(C2=O)C(=CC(=C3O)SC4=CC=C(C=C4)OCC)O

InChI

InChI=1S/C26H22O6S2/c1-3-31-15-5-9-17(10-6-15)33-21-13-19(27)24-23(25(21)29)20(28)14-22(26(24)30)34-18-11-7-16(8-12-18)32-4-2/h5-14,27,29H,3-4H2,1-2H3