(E)-2-(benzotriazol-1-yl)-3-(3-iodanylphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(benzotriazol-1-yl)-3-(3-iodanylphenyl)prop-2-enenitrile Openeye Name: (E)-2-(benzotriazol-1-yl)-3-(3-iodophenyl)prop-2-enenitrile CAS Name: (E)-2-(1-benzotriazolyl)-3-(3-iodophenyl)-2-propenenitrile IUPAC Name: (E)-2-(benzotriazol-1-yl)-3-(3-iodophenyl)prop-2-enenitrile Traditional Name: (E)-2-(benzotriazol-1-yl)-3-(3-iodophenyl)acrylonitrile Formula: C15H9IN4 MolecularWeight: 372.16323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(=CC3=CC(=CC=C3)I)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2/C(=C/C3=CC(=CC=C3)I)/C#N

InChI

InChI=1S/C15H9IN4/c16-12-5-3-4-11(8-12)9-13(10-17)20-15-7-2-1-6-14(15)18-19-20/h1-9H/b13-9+