2-[4-(1,2,4-triazol-1-yl)butoxy]benzenecarbonitrile

Systemtic Name: 2-[4-(1,2,4-triazol-1-yl)butoxy]benzenecarbonitrile Openeye Name: 2-[4-(1,2,4-triazol-1-yl)butoxy]benzonitrile CAS Name: 2-[4-(1,2,4-triazol-1-yl)butoxy]benzonitrile IUPAC Name: 2-[4-(1,2,4-triazol-1-yl)butoxy]benzonitrile Traditional Name: 2-[4-(1,2,4-triazol-1-yl)butoxy]benzonitrile Formula: C13H14N4O MolecularWeight: 242.27646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)OCCCCN2C=NC=N2

Isomeric SMILES

C1=CC=C(C(=C1)C#N)OCCCCN2C=NC=N2

InChI

InChI=1S/C13H14N4O/c14-9-12-5-1-2-6-13(12)18-8-4-3-7-17-11-15-10-16-17/h1-2,5-6,10-11H,3-4,7-8H2