1-(2-tridec-1-ynylphenyl)ethenylphosphonic acid

Systemtic Name: 1-(2-tridec-1-ynylphenyl)ethenylphosphonic acid Openeye Name: 1-(2-tridec-1-ynylphenyl)vinylphosphonic acid CAS Name: 1-(2-tridec-1-ynylphenyl)ethenylphosphonic acid IUPAC Name: 1-(2-tridec-1-ynylphenyl)ethenylphosphonic acid Traditional Name: 1-(2-tridec-1-ynylphenyl)vinylphosphonic acid Formula: C21H31O3P MolecularWeight: 362.442801

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC#CC1=CC=CC=C1C(=C)P(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCC#CC1=CC=CC=C1C(=C)P(=O)(O)O

InChI

InChI=1S/C21H31O3P/c1-3-4-5-6-7-8-9-10-11-12-13-16-20-17-14-15-18-21(20)19(2)25(22,23)24/h14-15,17-18H,2-12H2,1H3,(H2,22,23,24)