2-[3-[(5-iodanylfuran-2-yl)methylamino]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[(5-iodanylfuran-2-yl)methylamino]phenoxy]ethanenitrile Openeye Name: 2-[3-[(5-iodo-2-furyl)methylamino]phenoxy]acetonitrile CAS Name: 2-[3-[(5-iodo-2-furanyl)methylamino]phenoxy]acetonitrile IUPAC Name: 2-[3-[(5-iodofuran-2-yl)methylamino]phenoxy]acetonitrile Traditional Name: 2-[3-[(5-iodo-2-furyl)methylamino]phenoxy]acetonitrile Formula: C13H11IN2O2 MolecularWeight: 354.14311

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC#N)NCC2=CC=C(O2)I

Isomeric SMILES

C1=CC(=CC(=C1)OCC#N)NCC2=CC=C(O2)I

InChI

InChI=1S/C13H11IN2O2/c14-13-5-4-12(18-13)9-16-10-2-1-3-11(8-10)17-7-6-15/h1-5,8,16H,7,9H2