(E)-2-diethoxyphosphoryl-3-(1-methylimidazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-diethoxyphosphoryl-3-(1-methylimidazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-diethoxyphosphoryl-3-(1-methylimidazol-4-yl)prop-2-enenitrile CAS Name: (E)-2-diethoxyphosphoryl-3-(1-methyl-4-imidazolyl)-2-propenenitrile IUPAC Name: (E)-2-diethoxyphosphoryl-3-(1-methylimidazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-diethoxyphosphoryl-3-(1-methylimidazol-4-yl)acrylonitrile Formula: C11H16N3O3P MolecularWeight: 269.236801

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N3O3P/c1-4-16-18(15,17-5-2)11(7-12)6-10-8-14(3)9-13-10/h6,8-9H,4-5H2,1-3H3/b11-6+