2-[(2-chloranylphenoxy)-(2-cyanoethoxy)phosphoryl]oxytetradecanoic acid

Systemtic Name: 2-[(2-chloranylphenoxy)-(2-cyanoethoxy)phosphoryl]oxytetradecanoic acid Openeye Name: 2-[(2-chlorophenoxy)-(2-cyanoethoxy)phosphoryl]oxytetradecanoic acid CAS Name: 2-[(2-chlorophenoxy)-(2-cyanoethoxy)phosphoryl]oxytetradecanoic acid IUPAC Name: 2-[(2-chlorophenoxy)-(2-cyanoethoxy)phosphoryl]oxytetradecanoic acid Traditional Name: 2-[(2-chlorophenoxy)-(2-cyanoethoxy)phosphoryl]oxymyristic acid Formula: C23H35ClNO6P MolecularWeight: 487.953861

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(=O)O)OP(=O)(OCCC#N)OC1=CC=CC=C1Cl

Isomeric SMILES

CCCCCCCCCCCCC(C(=O)O)OP(=O)(OCCC#N)OC1=CC=CC=C1Cl

InChI

InChI=1S/C23H35ClNO6P/c1-2-3-4-5-6-7-8-9-10-11-17-22(23(26)27)31-32(28,29-19-14-18-25)30-21-16-13-12-15-20(21)24/h12-13,15-16,22H,2-11,14,17,19H2,1H3,(H,26,27)