2-[3-[(6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl)amino]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[(6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl)amino]phenoxy]ethanenitrile Openeye Name: 2-[3-[(6-hydroxy-2,3-dihydrobenzofuran-3-yl)amino]phenoxy]acetonitrile CAS Name: 2-[3-[(6-hydroxy-2,3-dihydrobenzofuran-3-yl)amino]phenoxy]acetonitrile IUPAC Name: 2-[3-[(6-hydroxy-2,3-dihydro-1-benzofuran-3-yl)amino]phenoxy]acetonitrile Traditional Name: 2-[3-[(6-hydroxycoumaran-3-yl)amino]phenoxy]acetonitrile Formula: C16H14N2O3 MolecularWeight: 282.29396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(O1)C=C(C=C2)O)NC3=CC(=CC=C3)OCC#N

Isomeric SMILES

C1C(C2=C(O1)C=C(C=C2)O)NC3=CC(=CC=C3)OCC#N

InChI

InChI=1S/C16H14N2O3/c17-6-7-20-13-3-1-2-11(8-13)18-15-10-21-16-9-12(19)4-5-14(15)16/h1-5,8-9,15,18-19H,7,10H2