(E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-thiophen-2-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(7-bromanyl-1,3-benzodioxol-5-yl)-2-thiophen-2-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-(thiophene-2-carbonyl)prop-2-enenitrile CAS Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-[oxo(thiophen-2-yl)methyl]-2-propenenitrile IUPAC Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-(thiophene-2-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-(7-bromo-1,3-benzodioxol-5-yl)-2-(2-thenoyl)acrylonitrile Formula: C15H8BrNO3S MolecularWeight: 362.19792

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=C(C#N)C(=O)C3=CC=CS3)Br

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=C(\C#N)/C(=O)C3=CC=CS3)Br

InChI

InChI=1S/C15H8BrNO3S/c16-11-5-9(6-12-15(11)20-8-19-12)4-10(7-17)14(18)13-2-1-3-21-13/h1-6H,8H2/b10-4+