2-[4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile CAS Name: 2-[4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(Z)-(3-phenyl-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetonitrile Formula: C17H13N5O MolecularWeight: 303.31802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=CN2N=CC3=CC=C(C=C3)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=CN2/N=C\C3=CC=C(C=C3)OCC#N

InChI

InChI=1S/C17H13N5O/c18-10-11-23-16-8-6-14(7-9-16)12-20-22-13-19-21-17(22)15-4-2-1-3-5-15/h1-9,12-13H,11H2/b20-12-