(2E)-2-[(3-nitro-4-oxidanyl-phenyl)methylidene]-1-benzothiophen-3-one

Systemtic Name: (2E)-2-[(3-nitro-4-oxidanyl-phenyl)methylidene]-1-benzothiophen-3-one Openeye Name: (2E)-2-[(4-hydroxy-3-nitro-phenyl)methylene]benzothiophen-3-one CAS Name: (2E)-2-[(4-hydroxy-3-nitrophenyl)methylidene]-1-benzothiophen-3-one IUPAC Name: (2E)-2-[(4-hydroxy-3-nitrophenyl)methylidene]-1-benzothiophen-3-one Traditional Name: (2E)-2-(4-hydroxy-3-nitro-benzylidene)benzothiophen-3-one Formula: C15H9NO4S MolecularWeight: 299.30126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=C(C=C3)O)[N+](=O)[O-])S2

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)/C(=C\C3=CC(=C(C=C3)O)[N+](=O)[O-])/S2

InChI

InChI=1S/C15H9NO4S/c17-12-6-5-9(7-11(12)16(19)20)8-14-15(18)10-3-1-2-4-13(10)21-14/h1-8,17H/b14-8+