(4-cyano-4-ethyl-1-phenyl-hexan-2-yl)phosphonic acid

Systemtic Name: (4-cyano-4-ethyl-1-phenyl-hexan-2-yl)phosphonic acid Openeye Name: (1-benzyl-3-cyano-3-ethyl-pentyl)phosphonic acid CAS Name: (4-cyano-4-ethyl-1-phenylhexan-2-yl)phosphonic acid IUPAC Name: (4-cyano-4-ethyl-1-phenylhexan-2-yl)phosphonic acid Traditional Name: (1-benzyl-3-cyano-3-ethyl-pentyl)phosphonic acid Formula: C15H22NO3P MolecularWeight: 295.313841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22NO3P/c1-3-15(4-2,12-16)11-14(20(17,18)19)10-13-8-6-5-7-9-13/h5-9,14H,3-4,10-11H2,1-2H3,(H2,17,18,19)