(4,6-dicyano-3-ethyl-hexan-3-yl)phosphonic acid

Systemtic Name: (4,6-dicyano-3-ethyl-hexan-3-yl)phosphonic acid Openeye Name: (2,4-dicyano-1,1-diethyl-butyl)phosphonic acid CAS Name: (4,6-dicyano-3-ethylhexan-3-yl)phosphonic acid IUPAC Name: (4,6-dicyano-3-ethylhexan-3-yl)phosphonic acid Traditional Name: (2,4-dicyano-1,1-diethyl-butyl)phosphonic acid Formula: C10H17N2O3P MolecularWeight: 244.227341

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H17N2O3P/c1-3-10(4-2,16(13,14)15)9(8-12)6-5-7-11/h9H,3-6H2,1-2H3,(H2,13,14,15)