2-[(E)-3-bromanyl-2-phenyl-prop-1-enyl]-4-(thiophen-3-ylmethoxy)benzenecarbonitrile

Systemtic Name: 2-[(E)-3-bromanyl-2-phenyl-prop-1-enyl]-4-(thiophen-3-ylmethoxy)benzenecarbonitrile Openeye Name: 2-[(E)-3-bromo-2-phenyl-prop-1-enyl]-4-(3-thienylmethoxy)benzonitrile CAS Name: 2-[(E)-3-bromo-2-phenylprop-1-enyl]-4-(3-thiophenylmethoxy)benzonitrile IUPAC Name: 2-[(E)-3-bromo-2-phenylprop-1-enyl]-4-(thiophen-3-ylmethoxy)benzonitrile Traditional Name: 2-[(E)-3-bromo-2-phenyl-prop-1-enyl]-4-(3-thenyloxy)benzonitrile Formula: C21H16BrNOS MolecularWeight: 410.32684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC2=C(C=CC(=C2)OCC3=CSC=C3)C#N)CBr

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\C2=C(C=CC(=C2)OCC3=CSC=C3)C#N)/CBr

InChI

InChI=1S/C21H16BrNOS/c22-12-20(17-4-2-1-3-5-17)10-19-11-21(7-6-18(19)13-23)24-14-16-8-9-25-15-16/h1-11,15H,12,14H2/b20-10-