2-[(E)-2-(6-bromanyl-1,3-benzodioxol-5-yl)ethenyl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(E)-2-(6-bromanyl-1,3-benzodioxol-5-yl)ethenyl]-5-nitro-benzenecarbonitrile Openeye Name: 2-[(E)-2-(6-bromo-1,3-benzodioxol-5-yl)vinyl]-5-nitro-benzonitrile CAS Name: 2-[(E)-2-(6-bromo-1,3-benzodioxol-5-yl)ethenyl]-5-nitrobenzonitrile IUPAC Name: 2-[(E)-2-(6-bromo-1,3-benzodioxol-5-yl)ethenyl]-5-nitrobenzonitrile Traditional Name: 2-[(E)-2-(6-bromo-1,3-benzodioxol-5-yl)vinyl]-5-nitro-benzonitrile Formula: C16H9BrN2O4 MolecularWeight: 373.15766

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=CC3=C(C=C(C=C3)[N+](=O)[O-])C#N)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=C/C3=C(C=C(C=C3)[N+](=O)[O-])C#N)Br

InChI

InChI=1S/C16H9BrN2O4/c17-14-7-16-15(22-9-23-16)6-11(14)2-1-10-3-4-13(19(20)21)5-12(10)8-18/h1-7H,9H2/b2-1+