2-[4-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]propanenitrile

Systemtic Name: 2-[4-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]propanenitrile Openeye Name: 2-[4-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]propanenitrile CAS Name: 2-[4-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]propanenitrile IUPAC Name: 2-[4-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]propanenitrile Traditional Name: 2-[4-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]propionitrile Formula: C17H14N2O2 MolecularWeight: 278.30526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)OC

Isomeric SMILES

CC(C#N)C1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)OC

InChI

InChI=1S/C17H14N2O2/c1-11(10-18)13-8-7-12(9-16(13)20-2)17-19-14-5-3-4-6-15(14)21-17/h3-9,11H,1-2H3