3-[2-cyanoethyl-(2,4,6-trimethylphenyl)carbonyl-phosphoryl]propanenitrile

Systemtic Name: 3-[2-cyanoethyl-(2,4,6-trimethylphenyl)carbonyl-phosphoryl]propanenitrile Openeye Name: 3-[2-cyanoethyl-(2,4,6-trimethylbenzoyl)phosphoryl]propanenitrile CAS Name: 3-[2-cyanoethyl-[oxo-(2,4,6-trimethylphenyl)methyl]phosphoryl]propanenitrile IUPAC Name: 3-[2-cyanoethyl-(2,4,6-trimethylbenzoyl)phosphoryl]propanenitrile Traditional Name: 3-[2-cyanoethyl-(2,4,6-trimethylbenzoyl)phosphoryl]propionitrile Formula: C16H19N2O2P MolecularWeight: 302.308021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)P(=O)(CCC#N)CCC#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)P(=O)(CCC#N)CCC#N)C

InChI

InChI=1S/C16H19N2O2P/c1-12-10-13(2)15(14(3)11-12)16(19)21(20,8-4-6-17)9-5-7-18/h10-11H,4-5,8-9H2,1-3H3