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

Systemtic Name: 2-[3-[(5-chloranyl-2-oxidanyl-phenyl)methylamino]phenoxy]ethanenitrile Openeye Name: 2-[3-[(5-chloro-2-hydroxy-phenyl)methylamino]phenoxy]acetonitrile CAS Name: 2-[3-[(5-chloro-2-hydroxyphenyl)methylamino]phenoxy]acetonitrile IUPAC Name: 2-[3-[(5-chloro-2-hydroxyphenyl)methylamino]phenoxy]acetonitrile Traditional Name: 2-[3-[(5-chloro-2-hydroxy-benzyl)amino]phenoxy]acetonitrile Formula: C15H13ClN2O2 MolecularWeight: 288.72892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC#N)NCC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

C1=CC(=CC(=C1)OCC#N)NCC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C15H13ClN2O2/c16-12-4-5-15(19)11(8-12)10-18-13-2-1-3-14(9-13)20-7-6-17/h1-5,8-9,18-19H,7,10H2