7-iodanylbicyclo[2.2.1]hepta-1,3,5-triene; 2-phenylazanylprop-2-enenitrile

Systemtic Name: 7-iodanylbicyclo[2.2.1]hepta-1,3,5-triene; 2-phenylazanylprop-2-enenitrile Openeye Name: 2-anilinoprop-2-enenitrile; 7-iodobicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 2-anilino-2-propenenitrile; 7-iodobicyclo[2.2.1]hepta-1,3,5-triene IUPAC Name: 2-anilinoprop-2-enenitrile; 7-iodobicyclo[2.2.1]hepta-1,3,5-triene Traditional Name: 2-anilinoacrylonitrile; 7-iodobicyclo[2.2.1]hepta-1,3,5-triene Formula: C16H13IN2 MolecularWeight: 360.19229

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C#N)NC1=CC=CC=C1.C1=CC2=CC=C1C2I

Isomeric SMILES

C=C(C#N)NC1=CC=CC=C1.C1=CC2=CC=C1C2I

InChI

InChI=1S/C9H8N2.C7H5I/c1-8(7-10)11-9-5-3-2-4-6-9;8-7-5-1-2-6(7)4-3-5/h2-6,11H,1H2;1-4,7H