2-[3-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methylamino]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]methylamino]phenoxy]ethanenitrile Openeye Name: 2-[3-[(3,5-dichloro-2-hydroxy-phenyl)methylamino]phenoxy]acetonitrile CAS Name: 2-[3-[(3,5-dichloro-2-hydroxyphenyl)methylamino]phenoxy]acetonitrile IUPAC Name: 2-[3-[(3,5-dichloro-2-hydroxyphenyl)methylamino]phenoxy]acetonitrile Traditional Name: 2-[3-[(3,5-dichloro-2-hydroxy-benzyl)amino]phenoxy]acetonitrile Formula: C15H12Cl2N2O2 MolecularWeight: 323.17398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC#N)NCC2=CC(=CC(=C2O)Cl)Cl

Isomeric SMILES

C1=CC(=CC(=C1)OCC#N)NCC2=CC(=CC(=C2O)Cl)Cl

InChI

InChI=1S/C15H12Cl2N2O2/c16-11-6-10(15(20)14(17)7-11)9-19-12-2-1-3-13(8-12)21-5-4-18/h1-3,6-8,19-20H,5,9H2