(2E)-2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-1-benzothiophen-3-one

Systemtic Name: (2E)-2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-1-benzothiophen-3-one Openeye Name: (2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylene]benzothiophen-3-one CAS Name: (2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1-benzothiophen-3-one IUPAC Name: (2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-1-benzothiophen-3-one Traditional Name: (2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylene]benzothiophen-3-one Formula: C16H9BrO3S MolecularWeight: 361.20986

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=C3C(=O)C4=CC=CC=C4S3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=C/3\C(=O)C4=CC=CC=C4S3)Br

InChI

InChI=1S/C16H9BrO3S/c17-11-7-13-12(19-8-20-13)5-9(11)6-15-16(18)10-3-1-2-4-14(10)21-15/h1-7H,8H2/b15-6+