(Z)-4-ethyl-3-(phenylcarbonyl)-2-(1,2,4-triazol-1-yl)hex-2-enenitrile

Systemtic Name: (Z)-4-ethyl-3-(phenylcarbonyl)-2-(1,2,4-triazol-1-yl)hex-2-enenitrile Openeye Name: (Z)-3-benzoyl-4-ethyl-2-(1,2,4-triazol-1-yl)hex-2-enenitrile CAS Name: (Z)-3-benzoyl-4-ethyl-2-(1,2,4-triazol-1-yl)-2-hexenenitrile IUPAC Name: (Z)-3-benzoyl-4-ethyl-2-(1,2,4-triazol-1-yl)hex-2-enenitrile Traditional Name: (Z)-3-benzoyl-4-ethyl-2-(1,2,4-triazol-1-yl)hex-2-enenitrile Formula: C17H18N4O MolecularWeight: 294.35102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=C(C#N)N1C=NC=N1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(CC)/C(=C(\C#N)/N1C=NC=N1)/C(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H18N4O/c1-3-13(4-2)16(15(10-18)21-12-19-11-20-21)17(22)14-8-6-5-7-9-14/h5-9,11-13H,3-4H2,1-2H3/b16-15-