3-[bis(1H-imidazol-2-yl)phosphanyloxy]-4,4-dimethyl-pentanenitrile

Systemtic Name: 3-[bis(1H-imidazol-2-yl)phosphanyloxy]-4,4-dimethyl-pentanenitrile Openeye Name: 3-[bis(1H-imidazol-2-yl)phosphanyloxy]-4,4-dimethyl-pentanenitrile CAS Name: 3-[bis(1H-imidazol-2-yl)phosphinooxy]-4,4-dimethylpentanenitrile IUPAC Name: 3-[bis(1H-imidazol-2-yl)phosphanyloxy]-4,4-dimethylpentanenitrile Traditional Name: 3-[bis(1H-imidazol-2-yl)phosphinooxy]-4,4-dimethyl-valeronitrile Formula: C13H18N5OP MolecularWeight: 291.288681

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC#N)OP(C1=NC=CN1)C2=NC=CN2

Isomeric SMILES

CC(C)(C)C(CC#N)OP(C1=NC=CN1)C2=NC=CN2

InChI

InChI=1S/C13H18N5OP/c1-13(2,3)10(4-5-14)19-20(11-15-6-7-16-11)12-17-8-9-18-12/h6-10H,4H2,1-3H3,(H,15,16)(H,17,18)