(E)-2-diethoxyphosphoryl-3-(2-phenyl-1H-imidazol-5-yl)prop-2-enenitrile

Systemtic Name: (E)-2-diethoxyphosphoryl-3-(2-phenyl-1H-imidazol-5-yl)prop-2-enenitrile Openeye Name: (E)-2-diethoxyphosphoryl-3-(2-phenyl-1H-imidazol-5-yl)prop-2-enenitrile CAS Name: (E)-2-diethoxyphosphoryl-3-(2-phenyl-1H-imidazol-5-yl)-2-propenenitrile IUPAC Name: (E)-2-diethoxyphosphoryl-3-(2-phenyl-1H-imidazol-5-yl)prop-2-enenitrile Traditional Name: (E)-2-diethoxyphosphoryl-3-(2-phenyl-1H-imidazol-5-yl)acrylonitrile Formula: C16H18N3O3P MolecularWeight: 331.306181

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(=CC1=CN=C(N1)C2=CC=CC=C2)C#N)OCC

Isomeric SMILES

CCOP(=O)(/C(=C/C1=CN=C(N1)C2=CC=CC=C2)/C#N)OCC

InChI

InChI=1S/C16H18N3O3P/c1-3-21-23(20,22-4-2)15(11-17)10-14-12-18-16(19-14)13-8-6-5-7-9-13/h5-10,12H,3-4H2,1-2H3,(H,18,19)/b15-10+