2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]butanenitrile

Systemtic Name: 2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]butanenitrile Openeye Name: 2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]butanenitrile CAS Name: 2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]butanenitrile IUPAC Name: 2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]butanenitrile Traditional Name: 2-[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]butyronitrile Formula: C17H13ClN2O MolecularWeight: 296.75092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN2O/c1-2-11(10-19)13-5-8-16-15(9-13)20-17(21-16)12-3-6-14(18)7-4-12/h3-9,11H,2H2,1H3