2-[(3-ethoxy-5-iodanyl-4-oxidanyl-phenyl)methylidene]-1-benzothiophen-3-one

Systemtic Name: 2-[(3-ethoxy-5-iodanyl-4-oxidanyl-phenyl)methylidene]-1-benzothiophen-3-one Openeye Name: 2-[(3-ethoxy-4-hydroxy-5-iodo-phenyl)methylene]benzothiophen-3-one CAS Name: 2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-1-benzothiophen-3-one IUPAC Name: 2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-1-benzothiophen-3-one Traditional Name: 2-(3-ethoxy-4-hydroxy-5-iodo-benzylidene)benzothiophen-3-one Formula: C17H13IO3S MolecularWeight: 424.25279

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)C3=CC=CC=C3S2)I)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)C3=CC=CC=C3S2)I)O

InChI

InChI=1S/C17H13IO3S/c1-2-21-13-8-10(7-12(18)17(13)20)9-15-16(19)11-5-3-4-6-14(11)22-15/h3-9,20H,2H2,1H3