2-[3-(4-methoxyphenyl)-2,1-benzoxazol-7-yl]ethanenitrile

Systemtic Name: 2-[3-(4-methoxyphenyl)-2,1-benzoxazol-7-yl]ethanenitrile Openeye Name: 2-[3-(4-methoxyphenyl)-2,1-benzoxazol-7-yl]acetonitrile CAS Name: 2-[3-(4-methoxyphenyl)-2,1-benzoxazol-7-yl]acetonitrile IUPAC Name: 2-[3-(4-methoxyphenyl)-2,1-benzoxazol-7-yl]acetonitrile Traditional Name: 2-[3-(4-methoxyphenyl)anthranil-7-yl]acetonitrile Formula: C16H12N2O2 MolecularWeight: 264.27868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C=CC=C(C3=NO2)CC#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C=CC=C(C3=NO2)CC#N

InChI

InChI=1S/C16H12N2O2/c1-19-13-7-5-12(6-8-13)16-14-4-2-3-11(9-10-17)15(14)18-20-16/h2-8H,9H2,1H3