2-(4-ethynylphenyl)-2-(1,2,4-triazol-1-ylmethyl)pent-4-enenitrile

Systemtic Name: 2-(4-ethynylphenyl)-2-(1,2,4-triazol-1-ylmethyl)pent-4-enenitrile Openeye Name: 2-(4-ethynylphenyl)-2-(1,2,4-triazol-1-ylmethyl)pent-4-enenitrile CAS Name: 2-(4-ethynylphenyl)-2-(1,2,4-triazol-1-ylmethyl)-4-pentenenitrile IUPAC Name: 2-(4-ethynylphenyl)-2-(1,2,4-triazol-1-ylmethyl)pent-4-enenitrile Traditional Name: 2-(4-ethynylphenyl)-2-(1,2,4-triazol-1-ylmethyl)pent-4-enenitrile Formula: C16H14N4 MolecularWeight: 262.30916

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CN1C=NC=N1)(C#N)C2=CC=C(C=C2)C#C

Isomeric SMILES

C=CCC(CN1C=NC=N1)(C#N)C2=CC=C(C=C2)C#C

InChI

InChI=1S/C16H14N4/c1-3-9-16(10-17,11-20-13-18-12-19-20)15-7-5-14(4-2)6-8-15/h2-3,5-8,12-13H,1,9,11H2