2-[2-(phenylmethyl)-1,3-benzoxazol-5-yl]propanenitrile

Systemtic Name: 2-[2-(phenylmethyl)-1,3-benzoxazol-5-yl]propanenitrile Openeye Name: 2-(2-benzyl-1,3-benzoxazol-5-yl)propanenitrile CAS Name: 2-[2-(phenylmethyl)-1,3-benzoxazol-5-yl]propanenitrile IUPAC Name: 2-(2-benzyl-1,3-benzoxazol-5-yl)propanenitrile Traditional Name: 2-(2-benzyl-1,3-benzoxazol-5-yl)propionitrile Formula: C17H14N2O MolecularWeight: 262.30586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=CC2=C(C=C1)OC(=N2)CC3=CC=CC=C3

Isomeric SMILES

CC(C#N)C1=CC2=C(C=C1)OC(=N2)CC3=CC=CC=C3

InChI

InChI=1S/C17H14N2O/c1-12(11-18)14-7-8-16-15(10-14)19-17(20-16)9-13-5-3-2-4-6-13/h2-8,10,12H,9H2,1H3