2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hex-5-enenitrile

Systemtic Name: 2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hex-5-enenitrile Openeye Name: 2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hex-5-enenitrile CAS Name: 2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)-5-hexenenitrile IUPAC Name: 2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hex-5-enenitrile Traditional Name: 2-(2-methoxyphenyl)-2-(1,2,4-triazol-1-ylmethyl)hex-5-enenitrile Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CCC=C)(CN2C=NC=N2)C#N

Isomeric SMILES

COC1=CC=CC=C1C(CCC=C)(CN2C=NC=N2)C#N

InChI

InChI=1S/C16H18N4O/c1-3-4-9-16(10-17,11-20-13-18-12-19-20)14-7-5-6-8-15(14)21-2/h3,5-8,12-13H,1,4,9,11H2,2H3