(6E)-3-(2-oxidanyl-3-phenoxy-propoxy)-6-[(4-phenylphenyl)-sulfanyl-methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-3-(2-oxidanyl-3-phenoxy-propoxy)-6-[(4-phenylphenyl)-sulfanyl-methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-3-(2-hydroxy-3-phenoxy-propoxy)-6-[(4-phenylphenyl)-sulfanyl-methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-3-(2-hydroxy-3-phenoxypropoxy)-6-[mercapto-(4-phenylphenyl)methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-3-(2-hydroxy-3-phenoxypropoxy)-6-[(4-phenylphenyl)-sulfanylmethylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-3-(2-hydroxy-3-phenoxy-propoxy)-6-[mercapto-(4-phenylphenyl)methylene]cyclohexa-2,4-dien-1-one Formula: C28H24O4S MolecularWeight: 456.55276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=C3C=CC(=CC3=O)OCC(COC4=CC=CC=C4)O)S

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)/C(=C\3/C=CC(=CC3=O)OCC(COC4=CC=CC=C4)O)/S

InChI

InChI=1S/C28H24O4S/c29-23(18-31-24-9-5-2-6-10-24)19-32-25-15-16-26(27(30)17-25)28(33)22-13-11-21(12-14-22)20-7-3-1-4-8-20/h1-17,23,29,33H,18-19H2/b28-26+